SCHEMBL3341016

SCHEMBL3341016

CCc1cnc(N2CCC(Oc3cnc(C(=O)Nc4ccc(S(C)(=O)=O)nc4C)cn3)CC2)nc1

nearest known ligand 0.45

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 18/20 0.45
TMEM97 Q5BJF2 1/20 0.41
SIGMAR1 Q99720 1/20 0.41
GPR6 P46095 1/20 0.40
CYP2C9 P11712 3/20 0.40
KCNH2 Q12809 1/20 0.39

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
SCHEMBL3341603 0.90 GPR119 (0.47) GPR119CYP2C9KCNH2
SCHEMBL3344924 0.89 GPR119 (0.45) GPR119CYP2C9KCNH2
SCHEMBL3346772 0.85 GPR119 (0.47) GPR119CYP2C9KCNH2
SCHEMBL3342729 0.84 GPR119 (0.45) GPR119CYP2C9
SCHEMBL3343346 0.83 GPR119 (0.52) GPR119GPR6KCNH2
SCHEMBL3346467 0.82 GPR119 (0.46) GPR119CYP2C9
SCHEMBL3342841 0.81 GPR119 (0.60) GPR119CYP2C9KCNH2
SCHEMBL3346737 0.78 GPR119 (0.49) GPR119CYP2C9
SCHEMBL3348812 0.76 GPR119 (0.48) GPR119
SCHEMBL3348808 0.76 ACACB (0.47) GPR119

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