SCHEMBL9719812

SCHEMBL9719812

Nc1cccc(OCc2ccccn2)c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 2/20 0.60
SYK P43405 2/20 0.57
TLR4 O00206 1/20 0.52
TLR2 O60603 1/20 0.52
CYP3A4 P08684 2/20 0.51
TP53 P04637 1/20 0.51
APP P05067 1/20 0.51
PARP10 Q53GL7 1/20 0.51
ALDH1A1 P00352 2/20 0.50
KDM4E B2RXH2 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
TSHR P16473 1/20 0.49
KCNH2 Q12809 1/20 0.49
GPR132 Q9UNW8 1/20 0.45
ABCB1 P08183 1/20 0.45
HTR1A P08908 1/20 0.45
DRD2 P14416 1/20 0.45
CYP1A2 P05177 1/20 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
SCHEMBL8877675 0.84 SYK (0.58) MAOBSYKTLR4TLR2CYP3A4
SCHEMBL22964159 0.81 TLR4 (0.53) SYKTLR4TLR2CYP3A4APP
SCHEMBL30361386 0.81 PARP10 (0.64) MAOBSYKCYP3A4PARP10ALDH1A1
SCHEMBL3571325 0.81 PARP10 (0.64) MAOBSYKCYP3A4PARP10ALDH1A1
SCHEMBL791890 0.80 FFAR1 (0.61) MAOBSYKTLR4TLR2APP
SCHEMBL22597086 0.80 TLR4 (0.52) SYKTLR4TLR2CYP3A4PARP10
SCHEMBL29468767 0.80 MAOB (0.60) MAOBTLR4TLR2PARP10ALDH1A1
SCHEMBL13645800 0.80 KDM4E (0.55) SYKTLR4TLR2TP53ALDH1A1
SCHEMBL2649525 0.80 MAOB (0.60) MAOBTLR4TLR2PARP10ALDH1A1
SCHEMBL6445371 0.80 KCNH2 (0.67) MAOBSYKTLR4TLR2CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104496982-A Kinase Inhibitors, Prodrug Forms Thereof And Their Use In Therapy AUCKLAND UNISERVICES LTD 2015-04-08 CN claimed
US-9573887-B2 Naphthalene derivative DAITO CHEMIX CORPORATION (JP) 2017-02-21 US disclosed
EP-2599771-B1 NAPHTHALENE DERIVATIVE DAITO CHEMIX CORP (JP) 2016-09-14 EP disclosed
CN-104496982-A Kinase Inhibitors, Prodrug Forms Thereof And Their Use In Therapy AUCKLAND UNISERVICES LTD 2015-04-08 CN disclosed
US-20130184241-A1 Naphthalene Derivative KYOTO UNIVERSITY (JP) 2013-07-18 US disclosed
EP-2599771-A1 NAPHTHALENE DERIVATIVE Daito Chemix Corporation (JP) 2013-06-05 EP disclosed
CN-1092409-A The compound that is used for the treatment of leukotriene-related disease SMITHKLINE BEECHAM CORP (US) 1994-09-21 CN disclosed
CN-1073431-A The compound that is used for the treatment of leukotriene-related disease SMITHRLINE BEECHAM CORP (US) 1993-06-23 CN disclosed
US-5157039-A Lipoxygenase inhibitors LEO PHARMACEUTICAL PRODUCTS LTD. (DK) 1992-10-20 US disclosed
US-5109009-A QUINOLINE AND PYRIDINE COMPOUNDS AND INHIBITION OF 5-LIPOXYGENASES THEREWITH LEO PHARMACEUTICAL PRODUCTS LTD. (DK) 1992-04-28 US disclosed
CN-1058015-A Benzoic acid derivative SMITHKLINE BEECHAM CORP (US) 1992-01-22 CN disclosed
US-4826987-A Pyridyl and quinoline derivatives LEO PHARMACEUTICAL PRODUCTS LTD. (DK) 1989-05-02 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-20130184241-A1 Naphthalene Derivative VCP, NOC2L, VAT1 MAOB 2080/4885SYK 4877/4885TLR4 4744/4885

“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.