SCHEMBL7949464

SCHEMBL7949464

Cc1cccc(Cc2nc(-c3ccc4nccnc4c3)c(-c3cccc(C)n3)[nH]2)c1

nearest known ligand 0.75

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TGFBR1 P36897 20/20 0.75
MAPK14 Q16539 11/20 0.75
KDR P35968 2/20 0.75
RIPK2 O43353 1/20 0.75
ACVR1B P36896 1/20 0.75
MTOR P42345 1/20 0.62
PRKD1 Q15139 2/20 0.61
PDGFRA P16234 1/20 0.61
FLT1 P17948 1/20 0.61
FLT4 P35916 1/20 0.61

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
SCHEMBL7955970 0.91 TGFBR1 (0.70) TGFBR1MAPK14KDRRIPK2ACVR1B
SCHEMBL4876173 0.90 TGFBR1 (0.78) TGFBR1MAPK14KDRRIPK2ACVR1B
SCHEMBL3183616 0.90 TGFBR1 (0.72) TGFBR1MAPK14KDRRIPK2ACVR1B
SCHEMBL1648625 0.90 TGFBR1 (0.72) TGFBR1MAPK14KDRRIPK2ACVR1B
SCHEMBL3184672 0.87 TGFBR1 (0.69) TGFBR1MAPK14KDRRIPK2ACVR1B
SCHEMBL14086498 0.87 TGFBR1 (0.83) TGFBR1MAPK14KDRRIPK2ACVR1B
SCHEMBL3183367 0.87 TGFBR1 (0.68) TGFBR1MAPK14KDRRIPK2ACVR1B
SCHEMBL3185282 0.87 TGFBR1 (0.68) TGFBR1MAPK14KDRRIPK2ACVR1B
SCHEMBL1647238 0.87 TGFBR1 (0.68) TGFBR1MAPK14KDRRIPK2ACVR1B
SCHEMBL1646572 0.87 TGFBR1 (0.68) TGFBR1MAPK14KDRRIPK2ACVR1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2009150547-A2 2-PYRIDYL SUBSTITUTED IMIDAZOLES AS ALK4 AND/OR ALK4 INHIBITORS SK CHEMICALS CO., LTD (KR) 2009-12-17 WO disclosed