SCHEMBL4723690

SCHEMBL4723690

C#Cc1ccccc1Nc1cc(OC2CCN(OC(=O)OC(C)C)CC2)ncn1

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 13/20 0.49
FLT3 P36888 3/20 0.38
CDK2 P24941 1/20 0.38
CDK6 Q00534 1/20 0.38
ACACB O00763 2/20 0.37
CYP2C9 P11712 1/20 0.34
HCRTR1 O43613 1/20 0.33
HCRTR2 O43614 1/20 0.33
SCN9A Q15858 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
SCHEMBL391363 0.88 GPR119 (0.62) GPR119CYP2C9
SCHEMBL4721322 0.84 GPR119 (0.58) GPR119FLT3CDK2CDK6CYP2C9
SCHEMBL4723636 0.83 GPR119 (0.62) GPR119FLT3CDK2CDK6ACACB
SCHEMBL5046473 0.82 GPR119 (0.46) GPR119FLT3CDK2CDK6
SCHEMBL4718845 0.82 GPR119 (0.63) GPR119FLT3CDK2CDK6ACACB
SCHEMBL4720782 0.81 GPR119 (0.58) GPR119FLT3CDK2CDK6ACACB
SCHEMBL4719083 0.81 GPR119 (0.56) GPR119FLT3CDK2CDK6ACACB
SCHEMBL4723387 0.81 GPR119 (0.49) GPR119FLT3CDK2CDK6ACACB
SCHEMBL4721027 0.80 GPR119 (0.55) GPR119FLT3CDK2CDK6ACACB
SCHEMBL4724133 0.80 GPR119 (0.51) 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