SCHEMBL13534689

SCHEMBL13534689

C=C(O/N=C(\N)C(C)C)N1CCC(CCCOc2ccc(C(=O)N[C@@H]3CCOC3)c(F)c2)CC1

nearest known ligand 0.49

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ GPR119 Q8TDV5 12/20 0.49
▸ CRBN Q96SW2 1/20 0.39
▸ HRH3 Q9Y5N1 4/20 0.39
▸ KCNH2 Q12809 2/20 0.36
▸ DHODH Q02127 1/20 0.36
▸ RAB9A P51151 1/20 0.35

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
SCHEMBL4397843 0.78 GPR119 (0.42) GPR119
SCHEMBL11918183 0.77 GPR119 (0.49) GPR119CRBNHRH3KCNH2RAB9A
SCHEMBL2397230 0.76 GPR119 (0.51) GPR119CRBNHRH3KCNH2DHODH
SCHEMBL2397233 0.76 GPR119 (0.51) GPR119CRBNHRH3KCNH2DHODH
SCHEMBL4400648 0.72 GPR119 (0.43) GPR119HRH3
SCHEMBL13534650 0.72 GABRA5 (0.40) GPR119KCNH2
SCHEMBL2398388 0.72 GPR119 (0.54) GPR119CRBNHRH3KCNH2RAB9A
SCHEMBL1922857 0.71 GPR119 (0.68) GPR119
SCHEMBL14621454 0.70 GPR119 (0.49) GPR119CRBNKCNH2
SCHEMBL3614267 0.70 GPR119 (0.51) GPR119CRBN

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-2010004344-A1 PIPERIDINE GPCR AGONISTS PROSIDION LIMITED (GB) 2010-01-14 — — WO disclosed
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