SCHEMBL14237295

SCHEMBL14237295

CC(C)(C)C1CC(Oc2cc(=O)n(-c3ccc(C#N)c(F)c3)nc2C(N)=O)CCN1C(=O)O

nearest known ligand 0.38

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ GPR119 Q8TDV5 1/20 0.38
▸ KDM1A O60341 15/20 0.34
▸ F10 P00742 1/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ MAP3K14 Q99558 1/20 0.33
▸ CHRM2 P08172 1/20 0.33
▸ CHRM5 P08912 1/20 0.33
▸ CHRM1 P11229 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
SCHEMBL14237689 0.90 GPR119 (0.37) GPR119KDM1ASMN1; SMN2CHRM2CHRM5
SCHEMBL14237366 0.88 GPR119 (0.36) GPR119KDM1ACHRM2CHRM5CHRM1
SCHEMBL1549862 0.86 GPR119 (0.43) GPR119KDM1A
SCHEMBL14237570 0.84 SMN1; SMN2 (0.37) SMN1; SMN2
SCHEMBL2542239 0.82 GPR119 (0.48) GPR119KDM1A
SCHEMBL14237635 0.81 NPC1 (0.33) SMN1; SMN2
SCHEMBL2457907 0.81 GPR119 (0.45) GPR119KDM1ACHRM2CHRM5CHRM1
SCHEMBL2458138 0.79 GPR119 (0.41) GPR119KDM1ACHRM2CHRM5CHRM1
SCHEMBL14237490 0.78 GPR119 (0.42) GPR119KDM1A
SCHEMBL14237370 0.77 NPC1 (0.40) SMN1; SMN2

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-2313395-B1 PYRIDONE AND PYRIDAZONE ANALOGUES AS GPR119 MODULATORS BRISTOL MYERS SQUIBB CO (US) 2012-12-19 — — EP disclosed
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