SCHEMBL4721934

SCHEMBL4721934

CC(C)(C)OC(=O)ON1CCC(Oc2cc(Nc3ccc(Cl)cc3F)ncn2)CC1

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 8/20 0.51
MKNK1 Q9BUB5 1/20 0.42
KDR P35968 2/20 0.42
FGFR1 P11362 1/20 0.42
FLT1 P17948 1/20 0.42
USP30 Q70CQ3 1/20 0.40
EGFR P00533 4/20 0.40
SCN9A Q15858 1/20 0.36
ERBB2 P04626 1/20 0.36
TRPC3 Q13507 1/20 0.36
TRPC6 Q9Y210 1/20 0.36
BRAF P15056 1/20 0.36
CDK2 P24941 1/20 0.36
FLT3 P36888 1/20 0.36
CDK6 Q00534 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
SCHEMBL4719081 0.89 GPR119 (0.48) GPR119KDRBRAFCDK2FLT3
SCHEMBL4718549 0.88 GPR119 (0.46) GPR119MKNK1KDREGFRSCN9A
SCHEMBL390190 0.88 GPR119 (0.60) GPR119MKNK1USP30
SCHEMBL4719030 0.88 GPR119 (0.67) GPR119
SCHEMBL4721156 0.86 GPR119 (0.46) GPR119KDRSCN9ABRAFCDK2
SCHEMBL4719883 0.85 GPR119 (0.51) GPR119EGFRCDK2FLT3CDK6
SCHEMBL4719749 0.85 GPR119 (0.45) GPR119EGFRCDK2FLT3CDK6
SCHEMBL4723743 0.84 GPR119 (0.52) GPR119
SCHEMBL4718480 0.84 GPR119 (0.44) GPR119SCN9ACDK2FLT3CDK6
SCHEMBL4723151 0.83 GPR119 (0.44) GPR119CDK2CDK6

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