SCHEMBL20053541

SCHEMBL20053541

CC(C)(F)CN1CCC(COc2ccc(-c3ccc(C(=O)N4CCCC4)c(F)c3)cc2F)CC1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SLC6A9 P48067 5/20 0.41
KCNH2 Q12809 2/20 0.41
HRH3 Q9Y5N1 1/20 0.41
CPS1 P31327 3/20 0.40
GPR119 Q8TDV5 3/20 0.39
SCN9A Q15858 1/20 0.39
RBP4 P02753 1/20 0.37
SCN7A Q01118 2/20 0.37
SCN5A Q14524 1/20 0.37
CHRM4 P08173 1/20 0.37
CHRM2 P08172 1/20 0.37
CHRM5 P08912 1/20 0.37
CHRM1 P11229 1/20 0.37
CHRM3 P20309 1/20 0.37
PIK3CA P42336 1/20 0.37
MTOR P42345 1/20 0.37

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
SCHEMBL20053623 0.92 SLC6A9 (0.39) SLC6A9KCNH2HRH3CPS1GPR119
SCHEMBL15538965 0.91 PIK3CA (0.43) SLC6A9GPR119SCN9ARBP4PIK3CA
SCHEMBL20053539 0.91 XDH (0.42) SLC6A9KCNH2HRH3GPR119MTOR
SCHEMBL15539342 0.91 PIK3CA (0.43) SLC6A9GPR119SCN9ARBP4PIK3CA
SCHEMBL15538969 0.91 PIK3CA (0.43) SLC6A9GPR119SCN9ARBP4PIK3CA
SCHEMBL16803845 0.91 CPS1 (0.41) SLC6A9KCNH2CPS1GPR119RBP4
SCHEMBL20053607 0.91 GPR119 (0.44) KCNH2HRH3CPS1GPR119CHRM2
SCHEMBL15538572 0.89 PIK3CA (0.41) SLC6A9CPS1GPR119SCN9ARBP4
SCHEMBL15538015 0.89 PIK3CA (0.41) SLC6A9CPS1GPR119SCN9ARBP4
SCHEMBL15538017 0.89 PIK3CA (0.41) SLC6A9CPS1GPR119SCN9ARBP4

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
US-9944600-B2 Piperidine derivatives for GPR119 agonist CHONG KUN DANG PHARMACEUTICAL CORP. (KR) 2018-04-17 US disclosed