SCHEMBL13422985

SCHEMBL13422985

CCc1cnc(N2CCC(Oc3ccc(-c4ccc(N)cc4F)c4ccccc34)CC2)nc1

nearest known ligand 0.42

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 16/20 0.42
NOS3 P29474 1/20 0.39
NOS1 P29475 1/20 0.39
NOS2 P35228 1/20 0.39
SCD O00767 1/20 0.39
KIT P10721 1/20 0.38
DCK P27707 1/20 0.38

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
SCHEMBL3370717 0.84 GPR119 (0.43) GPR119SCDKIT
SCHEMBL3372018 0.84 GPR119 (0.48) GPR119
SCHEMBL8513552 0.70 GPR119 (0.51) GPR119
SCHEMBL3342636 0.70 GPR119 (0.60) GPR119
SCHEMBL12474776 0.70 GPR119 (0.38) GPR119
SCHEMBL2570672 0.69 GPR119 (0.59) GPR119
SCHEMBL2551042 0.69 GPR119 (0.59) GPR119
SCHEMBL12283007 0.69 GPR119 (0.59) GPR119
SCHEMBL1005428 0.69 SCD (0.47) GPR119SCD
SCHEMBL3178150 0.69 GPR119 (0.54) GPR119SCD

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
WO-2010048149-A2 HETEROCYCLIC MODULATORS OF GPR119 FOR TREATMENT OF DISEASE KALYPSYS, INC. (US) 2010-04-29 WO disclosed