SCHEMBL14237490

SCHEMBL14237490

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

nearest known ligand 0.42

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ GPR119 Q8TDV5 1/20 0.42
▸ KDM1A O60341 12/20 0.34
▸ GPR6 P46095 5/20 0.34
▸ NR3C2 P08235 2/20 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 0.87 GPR119 (0.37) GPR119KDM1ANR3C2
SCHEMBL14237616 0.85 GPR119 (0.39) GPR119
SCHEMBL1550309 0.84 GPR119 (0.43) GPR119KDM1ANR3C2
SCHEMBL1550702 0.81 GPR119 (0.58) GPR119
SCHEMBL14237635 0.79 NPC1 (0.33) GPR6
SCHEMBL2544987 0.78 GPR119 (0.50) GPR119
SCHEMBL14237366 0.78 GPR119 (0.36) GPR119KDM1A
SCHEMBL14237295 0.78 GPR119 (0.38) GPR119KDM1A
SCHEMBL2538658 0.77 KDM1A (0.41) KDM1A
Hydrochloric Acid SCHEMBL2546008 0.76 KDM1A (0.41) KDM1A

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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