SCHEMBL4721907

SCHEMBL4721907

Cc1ccc(Nc2cc(OC3CCN(OC(=O)OC(C)C)CC3)ncn2)cc1I

nearest known ligand 0.47

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 12/20 0.47
FLT3 P36888 3/20 0.38
CDK2 P24941 1/20 0.38
CDK6 Q00534 1/20 0.38
ACACB O00763 3/20 0.37
S1PR1 P21453 2/20 0.35

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
SCHEMBL388619 0.88 GPR119 (0.61) GPR119
SCHEMBL4724422 0.86 GPR119 (0.50) GPR119FLT3CDK2CDK6ACACB
SCHEMBL4723387 0.85 GPR119 (0.49) GPR119FLT3CDK2CDK6ACACB
SCHEMBL4722122 0.84 GPR119 (0.51) GPR119FLT3CDK2CDK6ACACB
SCHEMBL4718883 0.84 GPR119 (0.53) GPR119FLT3CDK2CDK6ACACB
SCHEMBL4720771 0.84 GPR119 (0.48) GPR119FLT3CDK2CDK6ACACB
SCHEMBL4718772 0.84 GPR119 (0.51) GPR119FLT3CDK2CDK6ACACB
SCHEMBL4722464 0.83 GPR119 (0.60) GPR119
SCHEMBL4723183 0.83 GPR119 (0.46) GPR119FLT3CDK2CDK6ACACB
SCHEMBL4723224 0.83 GPR119 (0.46) GPR119FLT3CDK2CDK6ACACB

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