SCHEMBL4720642

SCHEMBL4720642

CCCCNc1cc(F)c(Nc2cc(OC3CCN(OC(=O)OC(C)C)CC3)ncn2)cc1F

nearest known ligand 0.52

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 10/20 0.52
FLT3 P36888 3/20 0.34
CDK6 Q00534 2/20 0.34
CDK2 P24941 1/20 0.34
ACACB O00763 6/20 0.34
CDK1 P06493 1/20 0.33
CDK4 P11802 1/20 0.33

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
SCHEMBL4721558 0.95 GPR119 (0.53) GPR119FLT3CDK6CDK2ACACB
SCHEMBL4723227 0.91 GPR119 (0.53) GPR119FLT3CDK6CDK2ACACB
SCHEMBL4719555 0.91 GPR119 (0.52) GPR119FLT3CDK6CDK2ACACB
SCHEMBL4720782 0.89 GPR119 (0.58) GPR119FLT3CDK6CDK2ACACB
SCHEMBL386548 0.89 GPR119 (0.66) GPR119
SCHEMBL4718867 0.88 GPR119 (0.54) GPR119FLT3CDK6CDK2ACACB
SCHEMBL4720606 0.87 GPR119 (0.52) GPR119FLT3CDK6CDK2ACACB
SCHEMBL4722023 0.87 GPR119 (0.49) GPR119FLT3CDK6CDK2
SCHEMBL4765631 0.87 GPR119 (0.56) GPR119FLT3CDK6CDK2ACACB
SCHEMBL4719558 0.87 GPR119 (0.57) GPR119FLT3CDK6CDK2ACACB

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