SCHEMBL460095

SCHEMBL460095

CC(C)(C)OC(=O)N1CCC(Oc2cc(=S)n(-c3ccc(C#N)c(F)c3)cc2Cl)CC1

nearest known ligand 0.49

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ GPR119 Q8TDV5 14/20 0.49
▸ TBK1 Q9UHD2 3/20 0.43
▸ NPBWR1 P48145 1/20 0.41
▸ MCHR1 Q99705 1/20 0.41
▸ PDE4D Q08499 1/20 0.40
▸ JAK2 O60674 1/20 0.40
▸ JAK1 P23458 1/20 0.40

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
SCHEMBL2335893 0.91 GPR119 (0.50) GPR119TBK1NPBWR1MCHR1
SCHEMBL1550799 0.80 GPR119 (0.46) GPR119TBK1JAK2JAK1
SCHEMBL1550797 0.80 GPR119 (0.46) GPR119TBK1JAK2JAK1
SCHEMBL2336445 0.79 GPR119 (0.56) GPR119
SCHEMBL2336693 0.79 GPR119 (0.65) GPR119JAK2JAK1
SCHEMBL2458075 0.78 GPR119 (0.49) GPR119
SCHEMBL12333878 0.78 GPR119 (0.51) GPR119NPBWR1MCHR1PDE4D
SCHEMBL2520515 0.77 GPR119 (0.66) GPR119NPBWR1MCHR1
SCHEMBL8089497 0.76 GPR119 (0.56) GPR119TBK1PDE4D
SCHEMBL2544987 0.76 GPR119 (0.50) GPR119TBK1NPBWR1MCHR1PDE4D

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-2012011707-A2 SUBSTITUTED PYRIDINONE DERIVATIVES AND METHODS FOR MANUFACTURING THE SAME HYUNDAI PHARM CO., LTD. (KR) 2012-01-26 — — WO disclosed
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