SCHEMBL4563507

SCHEMBL4563507

CNc1ncc2c(c1C)NC(=O)N(c1cc(NC(=O)Nc3scc(C(C)(C)C)c3Cl)c(F)cc1C)C2

nearest known ligand 0.30

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KRAS P01116 1/20 0.30
RAF1 P04049 1/20 0.30
BRAF P15056 1/20 0.30
KDR P35968 1/20 0.30
MAP2K2 P36507 1/20 0.30
MAP2K1 Q02750 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
SCHEMBL1521572 0.83 RAF1 (0.35) KRASRAF1BRAFKDRMAP2K2
SCHEMBL4272236 0.81 RAB9A (0.44) RAF1BRAF
SCHEMBL4271546 0.81 BRAF (0.32) KRASRAF1BRAFKDRMAP2K2
SCHEMBL4281251 0.80 BRAF (0.33) KRASRAF1BRAFKDRMAP2K2
SCHEMBL4562970 0.77 BRAF (0.42) KRASRAF1BRAFKDRMAP2K2
SCHEMBL1521776 0.77 BRAF (0.36) KRASRAF1BRAFKDRMAP2K2
SCHEMBL1522007 0.76 BRAF (0.36) KRASRAF1BRAFKDRMAP2K2
SCHEMBL4271182 0.73 BRAF (0.43) KRASRAF1BRAFKDRMAP2K2
SCHEMBL4273911 0.73 RAB9A (0.43) RAF1BRAF
SCHEMBL4276058 0.72 BRAF (0.45) KRASRAF1BRAFKDRMAP2K2

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
EP-2063896-A2 KINASE INHIBITORS USEFUL FOR THE TREATMENT OF PROLIFERATIVE DISEASES Deciphera Pharmaceuticals, LLC. (US) 2009-06-03 EP claimed
WO-2008033999-A2 KINASE INHIBITORS USEFUL FOR THE TREATMENT OF PROLIFERATIVE DISEASES DECIPHERA PHARMACEUTICALS, LLC (US) 2008-03-20 WO claimed