SCHEMBL14237366

SCHEMBL14237366

CC(C)(C)C1CC(Oc2cc(=O)n(-c3ccc(C#N)c(F)c3)nc2CO)CCN1C(=O)O

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ GPR119 Q8TDV5 2/20 0.36
▸ KDM1A O60341 12/20 0.34
▸ CHRM2 P08172 2/20 0.34
▸ CHRM5 P08912 1/20 0.34
▸ CHRM1 P11229 1/20 0.34
▸ AR P10275 1/20 0.33
▸ CHRM4 P08173 1/20 0.32
▸ JAK2 O60674 2/20 0.32
▸ TBK1 Q9UHD2 2/20 0.32

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) GPR119KDM1ACHRM2CHRM5CHRM1
SCHEMBL14237295 0.88 GPR119 (0.38) GPR119KDM1ACHRM2CHRM5CHRM1
SCHEMBL2544231 0.86 GPR119 (0.42) GPR119KDM1ATBK1
SCHEMBL14237704 0.84 KCNH2 (0.36) —
SCHEMBL2542952 0.82 GPR119 (0.48) GPR119JAK2TBK1
SCHEMBL14237635 0.81 NPC1 (0.33) —
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) —

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 claimed
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