SCHEMBL14256161

SCHEMBL14256161

COc1cccc(C(=O)O[C@H]2CNCC[C@@H]2c2ccccc2)c1

nearest known ligand 0.60

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
REN P00797 4/20 0.60
HTR2C P28335 2/20 0.45
ALDH1A1 P00352 3/20 0.45
ABCB1 P08183 1/20 0.43
CCR5 P51681 1/20 0.43
MEN1 O00255 1/20 0.43
MAPK1 P28482 1/20 0.43
KMT2A Q03164 1/20 0.43
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
MAOB P27338 1/20 0.42
CES2 O00748 1/20 0.42
CES1 P23141 1/20 0.42
KDM4E B2RXH2 1/20 0.41
LMNA P02545 1/20 0.41
TSHR P16473 1/20 0.41

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
SCHEMBL14256159 0.86 REN (0.46) RENHTR2CMEN1KMT2A
SCHEMBL14256062 0.86 REN (0.53) REN
SCHEMBL14256163 0.86 REN (0.53) REN
SCHEMBL14256185 0.85 REN (0.47) REN
SCHEMBL14256195 0.84 MRGPRX1 (0.48) RENALDH1A1ABCB1NPC1RAB9A
SCHEMBL14256225 0.84 REN (0.45) RENNPC1RAB9A
SCHEMBL14256180 0.84 REN (0.46) REN
SCHEMBL14256174 0.83 REN (0.57) REN
SCHEMBL14256192 0.82 REN (0.51) RENHTR2CMAOB
SCHEMBL14256203 0.81 REN (0.48) REN

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7338965-B2 3,4-disubstituted, 3,5-disubstituted and 3,4,5-substituted piperidines PHARMACIA & UPJOHN COMPANY (US) 2008-03-04 US disclosed
US-7338965-B2 3,4-disubstituted, 3,5-disubstituted and 3,4,5-substituted piperidines PHARMACIA & UPJOHN COMPANY (US) 2008-03-04 US disclosed