SCHEMBL9001997

SCHEMBL9001997

NC(=S)N(CCSc1cccc2nccn12)c1ccc(Cl)cc1

nearest known ligand 0.30

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ CHEK1 O14757 1/20 0.30
▸ MAP4K4 O95819 1/20 0.30
▸ CSF1R P07333 1/20 0.30
▸ PRKACA P17612 1/20 0.30
▸ KDR P35968 1/20 0.30
▸ CDK8 P49336 1/20 0.30
▸ MAP2K1 Q02750 1/20 0.30
▸ ACVR1 Q04771 1/20 0.30
▸ MAP4K2 Q12851 1/20 0.30
▸ ROCK1 Q13464 1/20 0.30
▸ DYRK1A Q13627 1/20 0.30
▸ AURKB Q96GD4 1/20 0.30
▸ DYRK1B Q9Y463 1/20 0.30
▸ F10 P00742 1/20 0.30

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
SCHEMBL9002424 0.90 CDK8 (0.37) CHEK1MAP4K4CSF1RPRKACAKDR
SCHEMBL9002455 0.89 CDK8 (0.33) CHEK1MAP4K4CSF1RPRKACAKDR
SCHEMBL9002046 0.87 MAP4K2 (0.32) MAP4K2
SCHEMBL9001928 0.84 CDK8 (0.36) CHEK1MAP4K4CSF1RPRKACAKDR
SCHEMBL9001960 0.80 CDK8 (0.34) CHEK1MAP4K4CSF1RPRKACAKDR
SCHEMBL9001932 0.79 ALDH1A1 (0.34) CHEK1MAP4K4CSF1RPRKACAKDR
SCHEMBL9002232 0.79 CDK8 (0.37) CHEK1MAP4K4CSF1RPRKACAKDR
SCHEMBL9002396 0.73 CDK8 (0.34) CHEK1MAP4K4CSF1RPRKACAKDR
SCHEMBL9002002 0.72 MAPT (0.50) —
SCHEMBL9002610 0.71 HSD17B10 (0.34) CHEK1MAP4K4CSF1RPRKACAKDR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5587383-A CALMODULIN INHIBITORS; ANTIISCHEMIC AGENTS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1996-12-24 — — US disclosed
EP-0471236-B1 Imidazopyridine derivatives and their use TAKEDA CHEMICAL INDUSTRIES LTD (JP) 1995-03-15 — — EP disclosed
US-5395839-A Calmodulin and angiogenesis inhibitors TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1995-03-07 — — US disclosed
US-5244908-A Calmodulin inhibitors TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1993-09-14 — — US disclosed
EP-0471236-A1 Imidazopyridine derivatives and their use TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1992-02-19 — — EP disclosed
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