SCHEMBL7896883

SCHEMBL7896883

Fc1cccc2nccn12

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK8 P49336 2/20 0.58
ROCK1 Q13464 2/20 0.58
KDR P35968 2/20 0.58
MAP2K1 Q02750 2/20 0.58
DYRK1A Q13627 2/20 0.58
DYRK1B Q9Y463 2/20 0.58
CHEK1 O14757 1/20 0.58
MAP4K4 O95819 1/20 0.58
CSF1R P07333 1/20 0.58
PRKACA P17612 1/20 0.58
ACVR1 Q04771 1/20 0.58
MAP4K2 Q12851 1/20 0.58
AURKB Q96GD4 1/20 0.58
LIMK1 P53667 2/20 0.47
CLK4 Q9HAZ1 2/20 0.47
FLT1 P17948 1/20 0.47
CDK9 P50750 1/20 0.47
ADORA3 P0DMS8 1/20 0.42
DRD1 P21728 10/20 0.39
FLT3 P36888 2/20 0.37

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
Hydrochloric Acid SCHEMBL7972162 0.98 CDK8 (0.56) CDK8ROCK1KDRMAP2K1DYRK1A
SCHEMBL31478470 0.76 CDK8 (0.65) CDK8ROCK1KDRMAP2K1DYRK1A
SCHEMBL260187 0.74 CDK8 (0.53) CDK8ROCK1KDRMAP2K1DYRK1A
SCHEMBL18324191 0.74 CDK8 (0.53) CDK8ROCK1KDRMAP2K1DYRK1A
SCHEMBL334306 0.74 CDK8 (0.53) CDK8ROCK1KDRMAP2K1DYRK1A
SCHEMBL4770221 0.74 CDK8 (0.53) CDK8ROCK1KDRMAP2K1DYRK1A
SCHEMBL260258 0.74 CDK8 (0.56) CDK8ROCK1KDRMAP2K1DYRK1A
SCHEMBL21352246 0.74 CDK8 (0.53) CDK8ROCK1KDRMAP2K1DYRK1A
SCHEMBL22836801 0.74 CDK8 (0.53) CDK8ROCK1KDRMAP2K1DYRK1A
SCHEMBL10247 0.74 CDK8 (0.53) CDK8ROCK1KDRMAP2K1DYRK1A

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
WO-2010128995-A1 PHENOXYMETHYL HETEROCYCLIC COMPOUNDS ENVIVO PHARMACEUTICALS, INC. (US) 2010-11-11 WO disclosed
US-6235731-B1 REDUCING BLOOD LIPIDS, SUGARS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2001-05-22 US disclosed
EP-0915888-A1 FUSED IMIDAZOPYRIDINE DERIVATIVES AS ANTIHYPERLIPIDEMIC AGENTS Takeda Chemical Industries, Ltd. (JP) 1999-05-19 EP disclosed
WO-1997040051-A1 FUSED IMIDAZOPYRIDINE DERIVATIVES AS ANTIHYPERLIPIDEMIC AGENTS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1997-10-30 WO disclosed