SCHEMBL21042983

SCHEMBL21042983

CC(C)(F)CN1CCC(COc2ccc(-c3ccc(C(=O)N=O)c(F)c3)c(C#N)c2)CC1

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 3/20 0.39
TRPV4 Q9HBA0 1/20 0.38
PARP10 Q53GL7 2/20 0.38
PARP15 Q460N3 1/20 0.38
SCN9A Q15858 2/20 0.38
CHRM2 P08172 1/20 0.37
CHRM5 P08912 1/20 0.37
CHRM1 P11229 1/20 0.37
CHRM3 P20309 1/20 0.37
KDM1A O60341 4/20 0.36
SSTR5 P35346 1/20 0.36
KCNH2 Q12809 1/20 0.36
SCN7A Q01118 1/20 0.35
SCN5A Q14524 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
SCHEMBL15539410 0.91 SSTR5 (0.41) GPR119TRPV4PARP10PARP15SCN9A
SCHEMBL15538883 0.89 GPR119 (0.39) GPR119TRPV4PARP10PARP15SCN9A
SCHEMBL20053644 0.88 GPR119 (0.40) GPR119TRPV4PARP10PARP15SCN9A
SCHEMBL15540217 0.87 GPR119 (0.42) GPR119TRPV4PARP10PARP15SCN9A
SCHEMBL18849061 0.86 KDM1A (0.42) GPR119KDM1A
SCHEMBL18849091 0.85 GPR119 (0.40) GPR119KDM1A
SCHEMBL21042669 0.85 HCRTR2 (0.39) GPR119TRPV4PARP10PARP15SCN9A
SCHEMBL18842736 0.85 SSTR5 (0.41) GPR119TRPV4PARP10PARP15CHRM2
SCHEMBL18848866 0.85 SSTR5 (0.40) GPR119TRPV4PARP10PARP15SCN9A
SCHEMBL21535174 0.84 GPR119 (0.37) GPR119TRPV4PARP10PARP15SCN9A

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-3074384-B1 AMIDE DERIVATIVES FOR GPR119 AGONIST CHONG KUN DANG PHARMACEUTICAL CORP (KR) 2019-05-22 EP disclosed