SCHEMBL2333567

SCHEMBL2333567

COc1ccc(C(CCOC(N)=O)N2CCC(CNC(=O)n3c(=O)n(C4CC4)c4ccccc43)CC2)cc1

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HTR4 Q13639 3/20 0.45
OPRM1 P35372 4/20 0.40
OPRL1 P41146 3/20 0.40
L3MBTL1 Q9Y468 1/20 0.36
OPRD1 P41143 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
SLC6A2 P23975 1/20 0.36
SLC6A4 P31645 1/20 0.36
CCR3 P51677 1/20 0.36
FAAH O00519 1/20 0.35
ACHE P22303 1/20 0.35
KDM4E B2RXH2 1/20 0.35
ALDH1A1 P00352 1/20 0.35
MAPT P10636 1/20 0.35
HPGD P15428 1/20 0.35
MCL1 Q07820 1/20 0.35
TDP1 Q9NUW8 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
SCHEMBL2334884 0.92 HTR4 (0.46) HTR4OPRM1OPRL1SLC6A2SLC6A4
SCHEMBL2338629 0.91 HTR4 (0.44) HTR4OPRM1SLC6A2SLC6A4
SCHEMBL2334174 0.89 HTR4 (0.54) HTR4
SCHEMBL2331555 0.84 HTR4 (0.44) HTR4OPRM1OPRL1OPRD1MEN1
SCHEMBL15103640 0.82 HTR4 (0.49) HTR4OPRM1OPRL1OPRD1
SCHEMBL2341151 0.81 HTR4 (0.55) HTR4
SCHEMBL2336910 0.81 HTR4 (0.54) HTR4
SCHEMBL2335572 0.80 HTR4 (0.52) HTR4OPRM1OPRL1OPRD1
SCHEMBL3301436 0.78 OPRM1 (0.49) HTR4OPRM1OPRL1OPRD1
SCHEMBL2333316 0.75 HTR4 (0.44) HTR4OPRM1OPRL1OPRD1MEN1

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
EP-2358702-A2 PIPERIDINE COMPOUNDS, PHARMACEUTICAL COMPOSITION COMPRISING THE SAME AND ITS USE SK Holdings Co., Ltd. (KR) 2011-08-24 EP disclosed
WO-2010044585-A2 PIPERIDINE COMPOUNDS, PHARMACEUTICAL COMPOSITION COMPRISING THE SAME AND ITS USE SK HOLDINGS CO., LTD. (KR) 2010-04-22 WO disclosed