SCHEMBL4718549

SCHEMBL4718549

CC(C)(C)OC(=O)ON1CCC(Oc2cc(Nc3cc(F)ccc3F)ncn2)CC1

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 7/20 0.46
FLT3 P36888 3/20 0.38
CDK2 P24941 2/20 0.38
CDK6 Q00534 2/20 0.38
CCNT1 O60563 1/20 0.37
CCNA2 P20248 1/20 0.37
CCND3 P30281 1/20 0.37
CDK7 P50613 1/20 0.37
CDK9 P50750 1/20 0.37
CCNH P51946 1/20 0.37
MNAT1 P51948 1/20 0.37
CDK5 Q00535 1/20 0.37
CDK5R1 Q15078 1/20 0.37
MKNK1 Q9BUB5 1/20 0.36
KDR P35968 3/20 0.35
BRAF P15056 2/20 0.35
GPR6 P46095 3/20 0.35
SCN9A Q15858 1/20 0.34
EGFR P00533 1/20 0.34

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
SCHEMBL4719081 0.90 GPR119 (0.48) GPR119FLT3CDK2CDK6CCNT1
SCHEMBL4721934 0.88 GPR119 (0.51) GPR119FLT3CDK2CDK6MKNK1
SCHEMBL4721156 0.88 GPR119 (0.46) GPR119FLT3CDK2CDK6CCNT1
SCHEMBL4719083 0.88 GPR119 (0.56) GPR119FLT3CDK2CDK6GPR6
SCHEMBL389783 0.88 GPR119 (0.55) GPR119
SCHEMBL4719852 0.87 GPR119 (0.41) GPR119FLT3CDK2CDK6
SCHEMBL4723743 0.85 GPR119 (0.52) GPR119
SCHEMBL4718480 0.85 GPR119 (0.44) GPR119FLT3CDK2CDK6CCNT1
SCHEMBL4723151 0.85 GPR119 (0.44) GPR119CDK2CDK6CCNT1CCNA2
SCHEMBL4720846 0.84 GPR119 (0.41) GPR119FLT3CDK2CDK6KDR

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