SCHEMBL4748094

SCHEMBL4748094

N#Cc1ccccc1OC(=O)NC1CCCCC1

nearest known ligand 0.61

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 2/20 0.61
ALDH1A1 P00352 1/20 0.58
RAB9A P51151 1/20 0.58
FAAH O00519 2/20 0.52
LHCGR P22888 1/20 0.49
MAPT P10636 1/20 0.47
KDM4E B2RXH2 1/20 0.47

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
SCHEMBL31504164 0.86 EPHX1 (0.49) EPHX1ALDH1A1RAB9AFAAHMAPT
SCHEMBL9461065 0.80 EPHX1 (0.68) EPHX1ALDH1A1RAB9AFAAHLHCGR
SCHEMBL3850426 0.78 EPHX1 (0.66) EPHX1ALDH1A1RAB9AFAAHLHCGR
SCHEMBL7698620 0.78 ESR1 (0.54) RAB9AKDM4E
SCHEMBL830513 0.78 EPHX1 (0.66) EPHX1ALDH1A1RAB9AFAAHLHCGR
SCHEMBL4318377 0.78 EPHX1 (0.65) EPHX1ALDH1A1RAB9AFAAH
SCHEMBL15975470 0.76 EPHX1 (0.80) EPHX1ALDH1A1RAB9AFAAH
SCHEMBL12195983 0.76 EPHX1 (1.00) EPHX1ALDH1A1RAB9AFAAHLHCGR
SCHEMBL27620243 0.76 EPHX1 (0.67) EPHX1ALDH1A1RAB9AFAAH
SCHEMBL4748097 0.74 RAB9A (0.66) EPHX1ALDH1A1RAB9AFAAHLHCGR

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
WO-2008129129-A1 HETEROCYCLIC PHENYL CARBAMATES AS NOVEL FAAH-INHIBITORS KUOPION YLIOPISTO (FI) 2008-10-30 WO disclosed