SCHEMBL6937201

SCHEMBL6937201

NC1CCCN1c1ccccc1C1CC1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOS1 P29475 1/20 0.40
GAA P10253 2/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
CHRNA7 P36544 1/20 0.37
PGR P06401 1/20 0.36
KDM4E B2RXH2 1/20 0.36
ALDH1A1 P00352 1/20 0.36
MAPT P10636 1/20 0.36
SLC6A2 P23975 2/20 0.36
SLC6A4 P31645 2/20 0.36
SLC6A3 Q01959 2/20 0.36
CYP2D6 P10635 1/20 0.36
KCNH2 Q12809 1/20 0.36
UCHL1 P09936 1/20 0.35
HTR1A P08908 1/20 0.35
ADRA1B P35368 1/20 0.35
NOTUM Q6P988 1/20 0.35
MGLL Q99685 1/20 0.35
HCAR1 Q9BXC0 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
SCHEMBL28526319 0.76 PDK2 (0.48) MEN1KMT2ASLC6A2SLC6A4HTR1A
SCHEMBL23064484 0.76 HTR1A (0.38) NOS1GAAMEN1KMT2ACHRNA7
SCHEMBL24775518 0.76 GAA (0.36) NOS1GAAMEN1KMT2ACHRNA7
SCHEMBL2462253 0.72 NOS1 (0.36) NOS1GAAMEN1KMT2AKDM4E
SCHEMBL15966936 0.72 IDO1 (0.41) NOS1GAAKDM4EALDH1A1KCNH2
SCHEMBL15966960 0.72 RECQL (0.40) GAAKDM4EALDH1A1NOTUMHTR2C
SCHEMBL29139949 0.72 NOS1 (0.43) NOS1GAACHRNA7KDM4EALDH1A1
SCHEMBL484011 0.72 KMT2A (0.44) NOS1GAAMEN1KMT2ACHRNA7
SCHEMBL23064483 0.72 KEAP1 (0.48) GAAMEN1KMT2ACHRNA7KDM4E
SCHEMBL31198346 0.72 KEAP1 (0.48) GAAMEN1KMT2ACHRNA7KDM4E

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-1101756-B1 Aminopyrrolidine derivatives, processes for their preparation and pharmaceutical compositions comprising them SERVIER LAB (FR) 2003-03-19 EP claimed