SCHEMBL5201304

SCHEMBL5201304

Cc1ccc(C(C#N)(CCOC2CCCCO2)CCC(=O)O)cc1C

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
KDM4C Q9H3R0 1/20 0.34
NPC1 O15118 2/20 0.33
RAB9A P51151 2/20 0.33
CREBBP Q92793 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
ADORA3 P0DMS8 1/20 0.32
TSHR P16473 2/20 0.31
POLB P06746 1/20 0.31
EP300 Q09472 1/20 0.31
HTT P42858 1/20 0.31
HPGD P15428 2/20 0.30
GCK P35557 1/20 0.30
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 1/20 0.30
GLA P06280 1/20 0.30
GAA P10253 1/20 0.30
CYP2C19 P33261 1/20 0.30

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
SCHEMBL6492354 0.90 MEN1 (0.37) MEN1KMT2AKDM4CNPC1RAB9A
SCHEMBL7768719 0.87 MEN1 (0.40) MEN1KMT2AKDM4CNPC1RAB9A
SCHEMBL7768729 0.87 MEN1 (0.40) MEN1KMT2AKDM4CNPC1RAB9A
SCHEMBL7765828 0.82 MEN1 (0.41) MEN1KMT2AKDM4CNPC1RAB9A
SCHEMBL7426709 0.82 MEN1 (0.43) MEN1KMT2AKDM4CNPC1RAB9A
SCHEMBL6952332 0.80 SLC6A3 (0.36) MEN1KMT2AKDM4CNPC1RAB9A
SCHEMBL8366554 0.79 MEN1 (0.36) MEN1KMT2AKDM4CNPC1RAB9A
SCHEMBL7765726 0.78 MEN1 (0.41) MEN1KMT2AKDM4CNPC1RAB9A
SCHEMBL8124689 0.78 MEN1 (0.43) MEN1KMT2AKDM4CNPC1RAB9A
SCHEMBL3466801 0.78 MEN1 (0.34) MEN1KMT2ACREBBPL3MBTL1KDM4E

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-1150970-B1 (1-PHENACY-3-PHENYL-3-PIPERIDYLETHYL)PIPERIDINE DERIVATIVES, METHOD FOR THE PRODUCTION THEREOF AND PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME SANOFI AVENTIS (FR) 2007-08-22 EP disclosed