SCHEMBL2587134

SCHEMBL2587134

c1ccc(Oc2cccc(Oc3cccc(-c4ccccn4)c3)c2)nc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAP4K4 O95819 1/20 0.56
GRM5 P41594 4/20 0.53
TLR4 O00206 1/20 0.46
TLR2 O60603 1/20 0.46
IP6K1 Q92551 1/20 0.46
IP6K3 Q96PC2 1/20 0.46
IP6K2 Q9UHH9 1/20 0.46
GPR39 O43194 1/20 0.45
SMN1; SMN2 Q16637 3/20 0.44
CYP1A2 P05177 2/20 0.44
NPC1 O15118 2/20 0.44
RAB9A P51151 2/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 1/20 0.44
LMNA P02545 3/20 0.44
KDM4E B2RXH2 2/20 0.44
CCR1 P32246 2/20 0.44
CCR5 P51681 2/20 0.44
CCR8 P51685 2/20 0.44
BLM P54132 2/20 0.44

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL17500184 0.90 GRM5 (0.49) MAP4K4GRM5TLR4TLR2SMN1; SMN2
SCHEMBL31187765 0.90 GRM5 (0.49) MAP4K4GRM5TLR4TLR2SMN1; SMN2
SCHEMBL23526602 0.89 GRM5 (0.48) MAP4K4GRM5TLR4TLR2SMN1; SMN2
SCHEMBL31083655 0.89 GRM5 (0.48) MAP4K4GRM5TLR4TLR2SMN1; SMN2
SCHEMBL5109000 0.87 MAP4K4 (0.57) MAP4K4GRM5TLR4TLR2IP6K1
SCHEMBL15602369 0.87 TLR4 (0.55) MAP4K4GRM5TLR4TLR2IP6K1
SCHEMBL14032161 0.86 MAP4K4 (0.62) MAP4K4GRM5TLR4TLR2IP6K1
SCHEMBL14032071 0.85 MAP4K4 (0.54) MAP4K4GRM5IP6K1IP6K3IP6K2
SCHEMBL5108402 0.85 MAP4K4 (0.60) MAP4K4GRM5TLR4TLR2IP6K1
SCHEMBL29612417 0.85 TLR4 (0.56) MAP4K4GRM5TLR4TLR2IP6K1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 55 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10727422-B2 Synthesis of four coordinated palladium complexes and their applications in light emitting devices thereof ARIZONA BOARD OF REGENTS ON BEHALF OF ARIZONA STATE UNIVERSITY (US) 2020-07-28 US disclosed
US-10727422-B2 Synthesis of four coordinated palladium complexes and their applications in light emitting devices thereof ARIZONA BOARD OF REGENTS ON BEHALF OF ARIZONA STATE UNIVERSITY (US) 2020-07-28 US disclosed
US-20190312217-A1 SYNTHESIS OF FOUR COORDINATED PALLADIUM COMPLEXES AND THEIR APPLICATIONS IN LIGHT EMITTING DEVICES THEREOF UNIV ARIZONA STATE (US) 2019-10-10 US disclosed
US-20190312217-A1 SYNTHESIS OF FOUR COORDINATED PALLADIUM COMPLEXES AND THEIR APPLICATIONS IN LIGHT EMITTING DEVICES THEREOF UNIV ARIZONA STATE (US) 2019-10-10 US disclosed
US-10414785-B2 Pyridine-oxyphenyl coordinated iridium (III) complexes and methods of making and using ARIZONA BOARD OF REGENTS ACTING FOR AND ON BEHALF OF ARIZONA STATE UNIVERSITY (US) 2019-09-17 US disclosed
US-10263197-B2 Synthesis of four coordinated palladium complexes and their applications in light emitting devices thereof ARIZONA BOARD OF REGENTS ACTING FOR AND ON BEHALF OF ARIZONA STATE UNIVERSITY (US) 2019-04-16 US disclosed
US-10263197-B2 Synthesis of four coordinated palladium complexes and their applications in light emitting devices thereof ARIZONA BOARD OF REGENTS ACTING FOR AND ON BEHALF OF ARIZONA STATE UNIVERSITY (US) 2019-04-16 US disclosed
US-20180130960-A1 Synthesis of Four Coordinated Palladium Complexes and Their Applications in Light Emitting Devices Thereof ARIZONA BOARD OF REGENTS ACTING FOR AND ON BEHALF OF ARIZONA STATE UNIVERSITY 2018-05-10 US disclosed
US-20180130960-A1 Synthesis of Four Coordinated Palladium Complexes and Their Applications in Light Emitting Devices Thereof ARIZONA BOARD OF REGENTS ACTING FOR AND ON BEHALF OF ARIZONA STATE UNIVERSITY 2018-05-10 US disclosed
US-20180130960-A1 Synthesis of Four Coordinated Palladium Complexes and Their Applications in Light Emitting Devices Thereof ARIZONA BOARD OF REGENTS ACTING FOR AND ON BEHALF OF ARIZONA STATE UNIVERSITY 2018-05-10 US disclosed
US-20130203996-A1 Synthesis of Four Coordinated Palladium Complexes and Their Applications in Light Emitting Devices Thereof LI JIAN (US) 2013-08-08 US disclosed
US-20120264938-A1 Pyridine-Oxyphenyl Coordinated Iridium (III) Complexes and Methods of Making and Using ARIZONA BOARD OF REGENTS ACTING FOR AND ON BEHALF OF ARIZONA STATE UNIVERSITY 2012-10-18 US disclosed
US-20120264938-A1 Pyridine-Oxyphenyl Coordinated Iridium (III) Complexes and Methods of Making and Using ARIZONA BOARD OF REGENTS ACTING FOR AND ON BEHALF OF ARIZONA STATE UNIVERSITY 2012-10-18 US disclosed
WO-2012142387-A1 PYRIDINE-OXYPHENYL COORDINATED IRIDIUM (III) COMPLEXES AND METHODS OF MAKING AND USING ARIZONA BOARD OF REGENTS ACTING FOR AND ON BEHALF OF ARIZONA STATE UNIVERSITY (US) 2012-10-18 WO disclosed
US-20120095232-A1 SYNTHESIS OF FOUR COORDINATED PLATINUM COMPLEXES AND THEIR APPLICATIONS IN LIGHT EMITTING DEVICES THEREOF ARIZONA BOARD OF REGENTS ACTING FOR AND ON BEHALF OF ARIZONA STATE UNIVERSITY 2012-04-19 US disclosed
US-20120095232-A1 SYNTHESIS OF FOUR COORDINATED PLATINUM COMPLEXES AND THEIR APPLICATIONS IN LIGHT EMITTING DEVICES THEREOF ARIZONA BOARD OF REGENTS ACTING FOR AND ON BEHALF OF ARIZONA STATE UNIVERSITY 2012-04-19 US disclosed
WO-2011137431-A2 SYNTHESIS OF FOUR COORDINATED GOLD COMPLEXES AND THEIR APPLICATIONS IN LIGHT EMITTING DEVICES THEREOF ARIZONA BOARD OF REGENTS FOR AND ON BEHALF OF ARIZONA STATE UNIVERSITY (US) 2011-11-03 WO disclosed
WO-2011137431-A2 SYNTHESIS OF FOUR COORDINATED GOLD COMPLEXES AND THEIR APPLICATIONS IN LIGHT EMITTING DEVICES THEREOF ARIZONA BOARD OF REGENTS FOR AND ON BEHALF OF ARIZONA STATE UNIVERSITY (US) 2011-11-03 WO disclosed
WO-2011137429-A2 SYNTHESIS OF FOUR COORDINATED PALLADIUM COMPLEXES AND THEIR APPLICATIONS IN LIGHT EMITTING DEVICES THEREOF ARIZONA BOARD OF REGENTS ACTING FOR AND ON BEHALF OF ARIZONA STATE UNIVERSITY (US) 2011-11-03 WO disclosed
WO-2011137429-A2 SYNTHESIS OF FOUR COORDINATED PALLADIUM COMPLEXES AND THEIR APPLICATIONS IN LIGHT EMITTING DEVICES THEREOF ARIZONA BOARD OF REGENTS ACTING FOR AND ON BEHALF OF ARIZONA STATE UNIVERSITY (US) 2011-11-03 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (8 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20130203996-A1 Synthesis of Four Coordinated Palladium Complexes and Their Applications in Light Emitting Devices Thereof DDT, SOD1, PPOX MAP4K4 1182/4885GRM5 4096/4885TLR4 3892/4885
US-10414785-B2 Pyridine-oxyphenyl coordinated iridium (III) complexes and methods of making and using MT-CO3, INO80C, COX6C MAP4K4 1382/4885GRM5 3348/4885TLR4 3074/4885
US-20190312217-A1 SYNTHESIS OF FOUR COORDINATED PALLADIUM COMPLEXES AND THEIR APPLICATIONS IN LIGHT EMITTING DEVICES THEREOF DDT, SOD1, PPOX MAP4K4 1182/4885GRM5 4096/4885TLR4 3892/4885
US-20180130960-A1 Synthesis of Four Coordinated Palladium Complexes and Their Applications in Light Emitting Devices Thereof DDT, SOD1, PPOX MAP4K4 1182/4885GRM5 4096/4885TLR4 3892/4885
US-20120264938-A1 Pyridine-Oxyphenyl Coordinated Iridium (III) Complexes and Methods of Making and Using MT-CO3, INO80C, COX6C MAP4K4 1382/4885GRM5 3348/4885TLR4 3074/4885
US-20120095232-A1 SYNTHESIS OF FOUR COORDINATED PLATINUM COMPLEXES AND THEIR APPLICATIONS IN LIGHT EMITTING DEVICES THEREOF ERCC4, PPOX, ERCC1 MAP4K4 2649/4885GRM5 2250/4885TLR4 4053/4885
US-10727422-B2 Synthesis of four coordinated palladium complexes and their applications in light emitting devices thereof DDT, SOD1, PPOX MAP4K4 1182/4885GRM5 4096/4885TLR4 3892/4885
US-10263197-B2 Synthesis of four coordinated palladium complexes and their applications in light emitting devices thereof DDT, SOD1, PPOX MAP4K4 1182/4885GRM5 4096/4885TLR4 3892/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.