SCHEMBL4723304

SCHEMBL4723304

Cc1ccc(Nc2cc(OC3CCN(OC(=O)OC(C)(C)C)CC3)ncn2)cc1F

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 5/20 0.42
KDR P35968 7/20 0.38
BRAF P15056 3/20 0.38
DHODH Q02127 2/20 0.37
THRB P10828 1/20 0.37
FLT3 P36888 3/20 0.36
CDK2 P24941 1/20 0.36
CDK6 Q00534 1/20 0.36
ERBB2 P04626 1/20 0.36

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
SCHEMBL4721657 0.90 KDR (0.41) GPR119KDRBRAFERBB2
SCHEMBL390908 0.88 GPR119 (0.51) GPR119THRB
SCHEMBL4721923 0.87 GPR119 (0.39) GPR119KDRBRAFFLT3CDK2
SCHEMBL4720846 0.87 GPR119 (0.41) GPR119KDRFLT3CDK2CDK6
SCHEMBL4719350 0.86 GPR119 (0.40) GPR119FLT3CDK2CDK6
SCHEMBL4722419 0.86 GPR119 (0.41) GPR119FLT3CDK2CDK6
SCHEMBL4719081 0.84 GPR119 (0.48) GPR119KDRBRAFFLT3CDK2
SCHEMBL4719882 0.84 ERBB2 (0.39) GPR119KDRFLT3CDK2CDK6
SCHEMBL4721904 0.84 TRPV1 (0.44) GPR119THRBFLT3CDK2CDK6
SCHEMBL4720714 0.83 GPR119 (0.40) GPR119FLT3CDK2CDK6ERBB2

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-1756084-B1 SUBSTITUTED ARYL AND HETEROARYL DERIVATIVES AS MODULATORS OF METABOLISM AND THE PROPHYLAXIS AND TREATMENT OF DISORDERS RELATED THERETO ARENA PHARM INC (US) 2008-11-26 EP claimed