SCHEMBL4723041

SCHEMBL4723041

Cc1ccc(Nc2cc(OC3CCN(OC(=O)OC(C)C)CC3)ncn2)c(Cl)n1

nearest known ligand 0.55

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 15/20 0.55
FLT3 P36888 3/20 0.39
CDK2 P24941 1/20 0.39
CDK6 Q00534 1/20 0.39
ACACB O00763 1/20 0.39
CYP2C9 P11712 3/20 0.38
S1PR1 P21453 1/20 0.36
KCNH2 Q12809 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
SCHEMBL4723636 0.91 GPR119 (0.62) GPR119FLT3CDK2CDK6ACACB
SCHEMBL4719749 0.88 GPR119 (0.45) GPR119FLT3CDK2CDK6ACACB
SCHEMBL388449 0.88 GPR119 (0.70) GPR119CYP2C9KCNH2
SCHEMBL4719420 0.85 GPR119 (0.61) GPR119FLT3CDK2CDK6CYP2C9
SCHEMBL4721651 0.84 GPR119 (0.60) GPR119FLT3CDK2CDK6CYP2C9
SCHEMBL4718883 0.84 GPR119 (0.53) GPR119FLT3CDK2CDK6ACACB
SCHEMBL4718845 0.83 GPR119 (0.63) GPR119FLT3CDK2CDK6ACACB
SCHEMBL4720771 0.83 GPR119 (0.48) GPR119FLT3CDK2CDK6ACACB
SCHEMBL4719070 0.83 GPR119 (0.53) GPR119ACACB
SCHEMBL13685341 0.83 GPR119 (0.53) GPR119FLT3CDK2CDK6CYP2C9

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