SCHEMBL4748097

SCHEMBL4748097

N#Cc1ccc(OC(=O)NC2CCCCC2)cc1

nearest known ligand 0.67

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.66
ALDH1A1 P00352 1/20 0.66
NPC1 O15118 1/20 0.62
EPHX1 P07099 2/20 0.59
FAAH O00519 2/20 0.58
TSHR P16473 1/20 0.53
LHCGR P22888 1/20 0.51

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
SCHEMBL4748350 0.83 FAAH (0.64) RAB9AALDH1A1EPHX1FAAH
SCHEMBL8074322 0.83 ALDH1A1 (0.76) RAB9AALDH1A1EPHX1FAAHLHCGR
SCHEMBL1690730 0.80 RAB9A (0.71) RAB9AALDH1A1NPC1EPHX1FAAH
SCHEMBL482831 0.80 ALDH1A1 (0.71) RAB9AALDH1A1EPHX1FAAHLHCGR
SCHEMBL1532563 0.80 ALDH1A1 (1.00) RAB9AALDH1A1EPHX1FAAHLHCGR
SCHEMBL21618461 0.80 ALDH1A1 (1.00) RAB9AALDH1A1EPHX1FAAHLHCGR
SCHEMBL8393776 0.80 ALDH1A1 (1.00) RAB9AALDH1A1EPHX1FAAHLHCGR
SCHEMBL4190588 0.79 ALDH1A1 (0.74) RAB9AALDH1A1EPHX1FAAHLHCGR
Bicarbonate SCHEMBL15226094 0.78 ALDH1A1 (0.97) RAB9AALDH1A1EPHX1FAAHLHCGR
SCHEMBL5115600 0.78 ALDH1A1 (0.97) RAB9AALDH1A1EPHX1FAAHLHCGR

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