SCHEMBL5225772

SCHEMBL5225772

O=C(c1cccnc1)C1CCCCN1C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FKBP1A P62942 1/20 0.47
ALDH1A1 P00352 4/20 0.47
KDM4E B2RXH2 2/20 0.47
MEN1 O00255 1/20 0.47
HPGD P15428 1/20 0.47
KMT2A Q03164 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
APP P05067 1/20 0.45
GAA P10253 1/20 0.45
HCAR3 P49019 1/20 0.45
HCAR2 Q8TDS4 1/20 0.45
DPP4 P27487 1/20 0.44
PREP P48147 1/20 0.44
FAP Q12884 1/20 0.44
DPP8 Q6V1X1 1/20 0.44
DPP9 Q86TI2 1/20 0.44
SLC18A3 Q16572 1/20 0.44
CNR2 P34972 1/20 0.43
HTT P42858 1/20 0.43
POLB P06746 1/20 0.43

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
SCHEMBL3088285 0.84 MCL1 (0.46) ALDH1A1HPGD
SCHEMBL5172182 0.84 MCL1 (0.46) ALDH1A1HPGD
SCHEMBL440331 0.83 KDM4E (0.45) KDM4EHPGDTDP1GAADPP4
SCHEMBL4834357 0.82 UCHL1 (0.49) FKBP1AALDH1A1KDM4EPOLB
SCHEMBL7592715 0.81 ALDH1A1 (0.61) FKBP1AALDH1A1TDP1CNR2HTT
SCHEMBL3001673 0.79 ALDH1A1 (0.49) ALDH1A1DPP4
SCHEMBL20482097 0.79 ALDH1A1 (0.49) ALDH1A1DPP4
SCHEMBL20482428 0.79 ALDH1A1 (0.49) ALDH1A1DPP4
SCHEMBL4776003 0.77 MGLL (0.48) ALDH1A1
SCHEMBL2226530 0.77 ALDH1A1 (0.66) ALDH1A1DPP4PREPFAPDPP8

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-100430394-C N- [ heteroaryl (piperidin-2-yl) methyl ] benzamide derivatives, their preparation and their therapeutic use SANOFI AVENTIS (FR) 2008-11-05 CN disclosed
EP-1680418-B1 DERIVATIVES OF N-[HETEROARYL(PIPERIDINE-2-YL)METHYL]BENZAMIDE, PREPARATION METHOD THEREOF AND APPLICATION OF SAME IN THERAPEUTICS SANOFI AVENTIS (FR) 2007-05-09 EP disclosed
CN-1882581-A N- [ heteroaryl (piperidin-2-yl) methyl ] benzamide derivatives, their preparation and their therapeutic use SANOFI AVENTIS (FR) 2006-12-20 CN disclosed
EP-1680418-A2 DERIVATIVES OF N-[HETEROARYL(PIPERIDINE-2-YL)METHYL]BENZAMIDE, PREPARATION METHOD THEREOF AND APPLICATION OF SAME IN THERAPEUTICS Sanofi-Aventis (FR) 2006-07-19 EP disclosed
WO-2005037781-A2 DERIVATIVES OF N-[HETEROARYL(PIPERIDINE-2-YL)METHYL]BENZAMIDE, PREPARATION METHOD THEREOF AND APPLICATION OF SAME IN THERAPEUTICS SANOFI-AVENTIS (FR) 2005-04-28 WO disclosed