SCHEMBL7365842

SCHEMBL7365842

CCc1[nH]c(-c2ccc(OC)cc2OC)nc1-c1ccncc1

nearest known ligand 0.70

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TGFBR1 P36897 1/20 0.70
TEK Q02763 8/20 0.50
NPC1 O15118 1/20 0.49
RAB9A P51151 1/20 0.49
PDE2A O00408 1/20 0.48
MAPK14 Q16539 5/20 0.46
MAPK13 O15264 4/20 0.46
MAPK12 P53778 4/20 0.46
MAPK11 Q15759 4/20 0.46
GCGR P47871 3/20 0.46
ALOX5 P09917 1/20 0.46
RAF1 P04049 2/20 0.45
NPY5R Q15761 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
SCHEMBL7369909 0.84 NPC1 (0.52) TGFBR1TEKNPC1RAB9APDE2A
Sb-202474 SCHEMBL6469103 0.82 TGFBR1 (1.00) TGFBR1TEKMAPK14MAPK13MAPK12
Sb-202474 SCHEMBL31118901 0.81 TGFBR1 (0.97) TGFBR1TEKMAPK14MAPK13MAPK12
SCHEMBL7371189 0.79 TGFBR1 (0.70) TGFBR1NPC1MAPK14MAPK13MAPK12
SCHEMBL7369293 0.77 CYP3A4 (0.52) NPC1PDE2ANPY5R
SCHEMBL4133106 0.74 NPC1 (0.64) NPC1RAB9A
SCHEMBL941325 0.73 NOX1 (0.61) TEKPDE2AMAPK14MAPK13MAPK12
SCHEMBL29363231 0.73 NOX1 (0.61) TEKPDE2AMAPK14MAPK13MAPK12
SCHEMBL7368577 0.72 NPC1 (0.47) TGFBR1TEKNPC1RAB9AMAPK14
SCHEMBL7370913 0.71 NPY5R (0.57) NPC1RAB9APDE2ANPY5R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4822805-A ANTIINFLAMMATORY AGENTS, CARDIOTONIC AGENTS, ANTIPLATELET AGENTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1989-04-18 US disclosed
EP-0257897-A1 Imidazole compounds, processes for the preparation thereof and pharmaceutical composition comprising the same FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1988-03-02 EP disclosed