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SCHEMBL282705

SCHEMBL282705

COc1ccc2nccc(Oc3ccc(NC(=O)NN(C(=O)Nc4ccc(Oc5ccnc6ccc(OC)cc56)cc4)c4ccc(Cl)c(C(F)(F)F)c4)cc3)c2c1

nearest known ligand 0.61

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ KDR P35968 11/20 0.61
▸ PDGFRA P16234 7/20 0.56
▸ RET P07949 3/20 0.56
▸ CSF1R P07333 1/20 0.56
▸ PDGFRB P09619 1/20 0.56
▸ KIT P10721 1/20 0.56
▸ DDR1 Q08345 1/20 0.56
▸ RAF1 P04049 2/20 0.51
▸ BRAF P15056 5/20 0.49

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
SCHEMBL717223 0.87 KDR (0.78) KDRPDGFRARETCSF1RPDGFRB
SCHEMBL282243 0.78 KDR (0.66) KDRPDGFRABRAF
SCHEMBL282138 0.77 KDR (0.61) KDRPDGFRARAF1BRAF
SCHEMBL282044 0.76 KDR (1.00) KDRPDGFRARETCSF1RPDGFRB
SCHEMBL281926 0.76 CSF1R (0.58) KDRPDGFRACSF1RPDGFRBKIT
SCHEMBL281915 0.75 CDK8 (0.48) KDRPDGFRAPDGFRBKITRAF1
SCHEMBL10073786 0.74 PDGFRA (0.80) KDRPDGFRAKIT
SCHEMBL22104156 0.72 PDGFRA (1.00) KDRPDGFRARETCSF1RPDGFRB
SCHEMBL718279 0.72 DDR2 (0.67) KDRPDGFRAKIT
SCHEMBL2614567 0.71 PDGFRA (0.66) KDRPDGFRARETCSF1RPDGFRB

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
EP-2428506-A1 HETEROCYCLIC SUBSTITUTED ACARDITE DERIVATES AND USE THEREOF Jiangsu Provincial Institute Of Materia Medica Co. (CN) 2012-03-14 — — EP claimed