SCHEMBL17883142

SCHEMBL17883142

CC(C)c1ccc2c(c1)-c1ccccc1N(c1ccc3c(=O)c4ccccc4oc3c1)c1ccccc1-c1ccccc1O2

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 1/20 0.39
MAOA P21397 5/20 0.37
NPC1 O15118 4/20 0.37
RAB9A P51151 3/20 0.37
CHRNA7 P36544 1/20 0.36
KCNH2 Q12809 1/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
TNKS O95271 1/20 0.35
PARP1 P09874 1/20 0.35
TNKS2 Q9H2K2 1/20 0.35
HDAC6 Q9UBN7 1/20 0.35
PARP2 Q9UGN5 1/20 0.35
TBK1 Q9UHD2 2/20 0.35
KDM4E B2RXH2 1/20 0.35
ALDH1A1 P00352 1/20 0.35
GLA P06280 1/20 0.35
CYP3A4 P08684 1/20 0.35
MAPT P10636 1/20 0.35
HPGD P15428 1/20 0.35

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
SCHEMBL17850864 0.93 NPC1 (0.39) PTGER4MAOANPC1RAB9ACHRNA7
SCHEMBL17883143 0.92 PTGER4 (0.37) PTGER4MAOANPC1RAB9ACHRNA7
SCHEMBL17850949 0.89 PTGER4 (0.47) PTGER4MAOANPC1RAB9ACHRNA7
SCHEMBL17883177 0.85 PTGER4 (0.42) PTGER4MAOANPC1RAB9ACHRNA7
SCHEMBL17850865 0.83 PTGER4 (0.39) PTGER4MAOANPC1RAB9ACHRNA7
SCHEMBL17850861 0.83 KDM4E (0.32) NPC1RAB9AMEN1KMT2AKDM4E
SCHEMBL17752254 0.82 PTGER4 (0.36) PTGER4MAOANPC1RAB9ACHRNA7
SCHEMBL17850996 0.81 PTGER4 (0.43) PTGER4MAOANPC1RAB9ACHRNA7
SCHEMBL17850950 0.80 NPC1 (0.46) PTGER4MAOANPC1RAB9ACHRNA7
SCHEMBL19319618 0.79 MAOA (0.50) PTGER4MAOANPC1RAB9ACHRNA7

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170213974-A1 ORGANIC LIGHT-EMITTING DEVICE, HOST MATERIAL, LIGHT-EMITTING MATERIAL, AND COMPOUND KYULUX, INC. (JP) 2017-07-27 US disclosed
US-20170163010-A1 ORGANIC LIGHT-EMITTING ELEMENT KYUSHU UNIVERSITY NATIONAL UNIVERSITY CORPORATION (JP) 2017-06-08 US disclosed
EP-3171421-A1 ORGANIC LIGHT-EMITTING ELEMENT Kyushu University, National University Corporation (JP) 2017-05-24 EP disclosed
US-20160190478-A1 ORGANIC ELECTROLUMINESCENT DEVICE KYUSHU UNIVERSITY, NATIONAL UNIVERSITY CORPORATION (JP) 2016-06-30 US 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 (1 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-20170213974-A1 ORGANIC LIGHT-EMITTING DEVICE, HOST MATERIAL, LIGHT-EMITTING MATERIAL, AND COMPOUND CRY1, CRY2, CYBA PTGER4 2137/4885MAOA 472/4885NPC1 3146/4885

“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.