SCHEMBL9642811

SCHEMBL9642811

COc1c(OC)c(OC(=O)c2ccccc2)c2ccc(Cl)cc2c1OCc1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ABCB11 O95342 1/20 0.54
LMNA P02545 1/20 0.46
HPGD P15428 1/20 0.46
MAOB P27338 3/20 0.42
MAOA P21397 2/20 0.42
KCNA3 P22001 1/20 0.42
MRGPRX4 Q96LA9 3/20 0.41
USP2 O75604 1/20 0.41
ALDH1A1 P00352 1/20 0.41
TSHR P16473 1/20 0.41
HSD17B10 Q99714 1/20 0.41
GLRA1 P23415 1/20 0.41
PTGER1 P34995 1/20 0.41
MAPT P10636 1/20 0.41

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
SCHEMBL9642172 0.91 ABCB11 (0.50) ABCB11LMNAHPGDMAOBMAOA
SCHEMBL9643565 0.89 ABCB11 (0.67) ABCB11LMNAHPGDALDH1A1TSHR
SCHEMBL9642978 0.85 ABCB11 (0.53) ABCB11LMNAHPGDKCNA3PTGER1
SCHEMBL9643065 0.85 ABCB11 (0.53) ABCB11LMNAHPGDKCNA3PTGER1
SCHEMBL9643216 0.83 MAPT (0.39) ABCB11LMNAHPGDMRGPRX4GLRA1
SCHEMBL9642080 0.82 ABCB11 (0.57) ABCB11LMNAALDH1A1TSHRMAPT
SCHEMBL9642865 0.82 ABCB11 (0.57) ABCB11LMNAALDH1A1TSHRMAPT
SCHEMBL9641751 0.82 HPGD (0.46) HPGDMAOBMAOAMRGPRX4ALDH1A1
SCHEMBL9654914 0.81 ABCB11 (0.59) ABCB11MRGPRX4ALDH1A1HSD17B10
SCHEMBL29372079 0.79 ABCB11 (0.49) ABCB11LMNAHPGDUSP2ALDH1A1

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
EP-0215622-B1 NAPHTHALENE ANTI-PSORIATIC AGENTS AND PROCESS FOR MAKING THEM SYNTEX (U.S.A.) INC. (US) 1992-06-17 EP disclosed
US-4946845-A STABLE ANTIINFLAMMATORY AGENTS, LIPOXYGENASE INHIBITORS SYNTEX (U.S.A.) INC. (US) 1990-08-07 US disclosed
US-4792556-A LIPOXYGENASE INHIBITORS SYNTEX (U.S.A.) INC. (US) 1988-12-20 US disclosed
EP-0215622-A2 Naphthalene anti-psoriatic agents and process for making them SYNTEX (U.S.A.) INC. (US) 1987-03-25 EP disclosed