SCHEMBL8038558

SCHEMBL8038558

NC1OC1c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 8/20 0.46
MAOA P21397 7/20 0.46
KDM1A O60341 5/20 0.46
CYP2C19 P33261 4/20 0.46
CYP2B6 P20813 3/20 0.46
CYP1A2 P05177 3/20 0.46
LMNA P02545 3/20 0.46
CYP2D6 P10635 2/20 0.46
CYP2C9 P11712 2/20 0.46
TAAR1 Q96RJ0 2/20 0.46
SLC6A2 P23975 2/20 0.46
SLC6A3 Q01959 2/20 0.46
CYP3A4 P08684 2/20 0.46
HTR1A P08908 1/20 0.46
ADRA2A P08913 1/20 0.46
CYP2A6 P11509 1/20 0.46
HTR2C P28335 1/20 0.46
ADRA1A P35348 1/20 0.46
DRD3 P35462 1/20 0.46
KCNH2 Q12809 1/20 0.46

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
SCHEMBL3644410 0.78 EPHX1 (0.52) MAOBMAOAKDM1ACYP2C19CYP2B6
SCHEMBL1103798 0.78 EPHX1 (0.52) MAOBMAOAKDM1ACYP2C19CYP2B6
SCHEMBL270441 0.78 EPHX1 (0.52) MAOBMAOAKDM1ACYP2C19CYP2B6
SCHEMBL1199046 0.78 EPHX1 (0.52) MAOBMAOAKDM1ACYP2C19CYP2B6
SCHEMBL12914371 0.78 EPHX1 (0.52) MAOBMAOAKDM1ACYP2C19CYP2B6
SCHEMBL1199563 0.78 EPHX1 (0.52) MAOBMAOAKDM1ACYP2C19CYP2B6
SCHEMBL63809 0.78 EPHX1 (0.52) MAOBMAOAKDM1ACYP2C19CYP2B6
SCHEMBL6570141 0.75 EPHX1 (0.50) MAOBMAOAKDM1ACYP2C19CYP2B6
Lithium SCHEMBL29397282 0.75 EPHX1 (0.50) MAOBMAOAKDM1ACYP2C19CYP2B6
SCHEMBL4279301 0.75 EPHX1 (0.50) MAOBMAOAKDM1ACYP2C19CYP2B6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2895457-B1 OLIGOMER-CONTAINING BENZAMIDE-BASED COMPOUNDS NEKTAR THERAPEUTICS (US) 2020-05-20 EP disclosed
US-20160319322-A1 PATHOGEN DETECTION UNIVERSITY OF NOTRE DAME DU LAC (US) 2016-11-03 US disclosed
US-6090865-A PHOTOINITIATOR SYSTEM COMPRISING (A) AT LEAST ONE O-ALKYLATED AROMATIC NITROGEN-HETEROCYCLE AMINE OXIDE CATION SALT AND (B) AT LEAST ONE ELECTRON DONOR COMPOUND. CIBA SPECIALTY CHEMICALS CORPORATION (US) 2000-07-18 US disclosed
CN-1217725-A polymerizable composition CIBA GEIGY AG (CH) 1999-05-26 CN disclosed
EP-0896587-A1 POLYMERISABLE COMPOSITION Ciba SC Holding AG (CH) 1999-02-17 EP disclosed
WO-1997042227-A1 POLYMERISABLE COMPOSITION CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 1997-11-13 WO disclosed