SCHEMBL7986590

SCHEMBL7986590

CCOC(=S)Cc1cccc2nccn12

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK8 P49336 2/20 0.40
ROCK1 Q13464 2/20 0.40
FLT1 P17948 1/20 0.40
CDK9 P50750 1/20 0.40
LIMK1 P53667 1/20 0.40
CLK4 Q9HAZ1 1/20 0.40
CHEK1 O14757 1/20 0.38
MAP4K4 O95819 1/20 0.38
CSF1R P07333 1/20 0.38
PRKACA P17612 1/20 0.38
KDR P35968 1/20 0.38
MAP2K1 Q02750 1/20 0.38
ACVR1 Q04771 1/20 0.38
MAP4K2 Q12851 1/20 0.38
DYRK1A Q13627 1/20 0.38
AURKB Q96GD4 1/20 0.38
DYRK1B Q9Y463 1/20 0.38
MAPK9 P45984 1/20 0.37
MAPK10 P53779 1/20 0.37
GAA P10253 2/20 0.35

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
SCHEMBL7846293 0.79 CDK8 (0.47) CDK8ROCK1FLT1CDK9LIMK1
SCHEMBL13458867 0.75 CDK8 (0.49) CDK8ROCK1FLT1CDK9LIMK1
SCHEMBL3775955 0.73 CDK8 (0.47) CDK8ROCK1FLT1CDK9LIMK1
SCHEMBL7986589 0.72 MAPK9 (0.41) CDK8ROCK1FLT1CDK9LIMK1
SCHEMBL7846380 0.72 CDK8 (0.49) CDK8ROCK1FLT1CDK9LIMK1
SCHEMBL7846291 0.72 MAPK9 (0.45) CDK8ROCK1FLT1CDK9LIMK1
SCHEMBL29456248 0.72 MAPK9 (0.45) CDK8ROCK1FLT1CDK9LIMK1
Hydrochloric Acid SCHEMBL19510410 0.72 CDK8 (0.46) CDK8ROCK1FLT1CDK9LIMK1
SCHEMBL4125150 0.71 GAA (0.48) CDK8ROCK1FLT1CDK9LIMK1
SCHEMBL3779831 0.71 MAPK9 (0.41) CDK8ROCK1FLT1CDK9LIMK1

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
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-1998025926-A1 IMIDAZOPYRIDINE DERIVATIVES AND THEIR PRODUCTION TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1998-06-18 WO disclosed
WO-1997040051-A1 FUSED IMIDAZOPYRIDINE DERIVATIVES AS ANTIHYPERLIPIDEMIC AGENTS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1997-10-30 WO disclosed