SCHEMBL15699577

SCHEMBL15699577

CC1(OC(=O)N2CCC(O[C@H]3CC[C@H](Oc4cccnc4C#N)CC3)CC2)CC1

nearest known ligand 0.52

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ GPR119 Q8TDV5 17/20 0.52
▸ SCD O00767 1/20 0.44
▸ CYP2C9 P11712 1/20 0.42
▸ CYP2C19 P33261 1/20 0.42
▸ RBP4 P02753 1/20 0.41
▸ KDM1A O60341 1/20 0.38

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
SCHEMBL15689502 0.85 GPR119 (0.55) GPR119SCDCYP2C9CYP2C19
SCHEMBL15689500 0.85 GPR119 (0.55) GPR119SCDCYP2C9CYP2C19
SCHEMBL15689498 0.82 GPR119 (0.54) GPR119SCDRBP4
SCHEMBL15689497 0.82 GPR119 (0.54) GPR119SCDRBP4
SCHEMBL15699581 0.82 GPR119 (0.54) GPR119SCDRBP4
SCHEMBL15699583 0.82 GPR119 (0.54) GPR119SCDRBP4
SCHEMBL14157572 0.81 GPR119 (0.55) GPR119CYP2C9CYP2C19
SCHEMBL14157573 0.81 GPR119 (0.55) GPR119CYP2C9CYP2C19
SCHEMBL14239293 0.77 GPR119 (0.51) GPR119CYP2C9CYP2C19
SCHEMBL26506522 0.75 SCD (0.41) SCD

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-2014074668-A1 MODULATORS OF GPR119 AND THE TREATMENT OF DISORDERS RELATED THERETO ARENA PHARMACEUTICALS, INC. (US) 2014-05-15 — — WO disclosed
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