SCHEMBL7969598

SCHEMBL7969598

NC/C=C/Oc1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
AOC3 Q16853 4/20 0.55
LTA4H P09960 2/20 0.42
TSHR P16473 1/20 0.42
TAAR1 Q96RJ0 1/20 0.41
PLA2G2A P14555 1/20 0.41
MAOB P27338 4/20 0.40
HRH1 P35367 1/20 0.38
MAOA P21397 3/20 0.38
AOC2 O75106 2/20 0.36
DAO P14920 1/20 0.36
KCNA3 P22001 1/20 0.36

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
SCHEMBL527141 1.00 AOC3 (0.55) AOC3LTA4HTSHRTAAR1PLA2G2A
SCHEMBL9501302 0.94 LTA4H (0.50) AOC3LTA4HTSHRPLA2G2AMAOB
SCHEMBL326201 0.82 MAOB (0.57) AOC3LTA4HMAOBMAOA
SCHEMBL11301704 0.79 TAAR1 (0.41) AOC3LTA4HTSHRTAAR1PLA2G2A
SCHEMBL8572677 0.78 IDO1 (0.53) AOC3LTA4HTSHRTAAR1PLA2G2A
SCHEMBL11541789 0.78 LTA4H (0.45) AOC3LTA4HTSHRTAAR1MAOB
SCHEMBL11541783 0.78 LTA4H (0.45) AOC3LTA4HTSHRTAAR1MAOB
SCHEMBL10785857 0.77 LTA4H (0.42) AOC3LTA4HTSHRTAAR1PLA2G2A
SCHEMBL4632159 0.77 LTA4H (0.43) AOC3LTA4HTSHRMAOAKCNA3
SCHEMBL5513094 0.77 LTA4H (0.43) AOC3LTA4HTSHRKCNA3

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6262078-B1 Phenoxymethyl piperidine derivatives for the treatment of neuropathic pain SYNTEX (U.S.A.) LLC 2001-07-17 US disclosed
US-6110937-A A SODIUM CHANNEL BLOCKER TREATING AS LOCAL ANESTHETICS AND IN THE TREATMENT OF CARDIAC ARRHYTHMIAS SYNTEX USA, INC. (US) 2000-08-29 US disclosed
EP-0869119-A1 Phenoxymethyl piperidine derivatives being sodium channle blockers F. HOFFMANN-LA ROCHE AG (CH) 1998-10-07 EP disclosed