SCHEMBL10691435

SCHEMBL10691435

COc1cc(NC(C)=O)ccc1-c1nc2c(=O)[nH]ncc2[nH]1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ROCK2 O75116 1/20 0.46
ROCK1 Q13464 1/20 0.46
MAOB P27338 4/20 0.43
IMPDH2 P12268 1/20 0.43
IMPDH1 P20839 1/20 0.43
MAOA P21397 1/20 0.43
PDE7A Q13946 2/20 0.42
FGFR1 P11362 1/20 0.41
FGFR2 P21802 1/20 0.41
THRB P10828 1/20 0.41
GSK3B P49841 2/20 0.40
DHODH Q02127 1/20 0.40
BRAF P15056 1/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
HPSE Q9Y251 1/20 0.40
PIM1 P11309 1/20 0.39
CSNK2A2 P19784 1/20 0.39
CSNK2B P67870 1/20 0.39
PIM3 Q86V86 1/20 0.39

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
SCHEMBL10693845 0.82 GAA (0.43) FGFR1DHODHLMNAMAPT
SCHEMBL10685364 0.81 MKNK1 (0.46) ROCK2ROCK1DHODH
SCHEMBL10692684 0.80 ADORA2B (0.46) DHODHLMNA
SCHEMBL10688606 0.80 PDE7A (0.48) IMPDH2IMPDH1PDE7AFGFR1FGFR2
SCHEMBL10688582 0.78 PDE5A (0.38) PDE7ADHODHNPC1RAB9ALMNA
SCHEMBL10686161 0.78 CDK4 (0.42) IMPDH2DHODHLMNA
SCHEMBL10690944 0.78 EGLN2 (0.39) ROCK2GSK3BDHODHPIM1CSNK2A2
SCHEMBL10691729 0.77 MEN1 (0.41) THRBDHODHLMNAMAPTL3MBTL1
SCHEMBL10869682 0.77 KDM4E (0.43) FGFR1DHODHNPC1RAB9AMAPT
SCHEMBL10686472 0.77 PDE5A (0.37) PDE7ADHODHCSNK2A2CSNK2BLMNA

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-4722929-A Novel 2-phenyl-imidazoles and pharmaceutical compositions containing same DR. KARL THOMAE GMBH (DE) 1988-02-02 US disclosed
EP-0149200-A1 Novel 2-pnenyl-imidazoles, their preparation and drugs containing them Dr. Karl Thomae GmbH (DE) 1985-07-24 EP disclosed