SCHEMBL8697182

SCHEMBL8697182

O=C(Cc1ccccc1)Nc1cc(Cl)c(Cl)cc1[N+](=O)[O-]

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.60
PKM P14618 1/20 0.60
KMT2A Q03164 5/20 0.56
MEN1 O00255 3/20 0.56
MAPT P10636 1/20 0.55
ALDH1A1 P00352 3/20 0.54
SMN1; SMN2 Q16637 1/20 0.54
CA1 P00915 1/20 0.53
CA2 P00918 1/20 0.53
CA5A P35218 1/20 0.53
CA7 P43166 1/20 0.53
CA5B Q9Y2D0 1/20 0.53
LMNA P02545 2/20 0.53
RAB9A P51151 4/20 0.51
GAA P10253 2/20 0.51
NPC1 O15118 3/20 0.49
MAPK1 P28482 1/20 0.49
HTT P42858 1/20 0.48
HPGD P15428 1/20 0.48
CDK2 P24941 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
SCHEMBL8801786 0.87 L3MBTL1 (0.53) L3MBTL1PKMKMT2AMEN1MAPT
SCHEMBL8933169 0.86 L3MBTL1 (0.52) L3MBTL1PKMKMT2AMEN1MAPT
SCHEMBL1455302 0.85 MAPT (0.57) L3MBTL1PKMKMT2AMEN1MAPT
SCHEMBL8803437 0.84 MAPK1 (0.68) L3MBTL1PKMKMT2AMEN1MAPT
SCHEMBL8802550 0.83 MAPK1 (0.58) L3MBTL1PKMKMT2AMEN1MAPT
SCHEMBL8692388 0.83 KMT2A (0.67) KMT2AMEN1MAPTALDH1A1SMN1; SMN2
SCHEMBL11041589 0.82 MEN1 (0.56) L3MBTL1PKMKMT2AMEN1MAPT
SCHEMBL3260677 0.81 RAB9A (0.74) L3MBTL1PKMKMT2AMEN1ALDH1A1
SCHEMBL27406580 0.81 LMNA (0.70) L3MBTL1PKMKMT2AMEN1MAPT
SCHEMBL12218527 0.81 KMT2A (0.70) L3MBTL1KMT2AMEN1MAPTALDH1A1

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-5801183-A HETEROCYCLC ALCOHOLS FOR NERVOUS SYSTEM DISORDERS STATE OF OREGON, ACTING BY AND THROUGH THE OREGON STATE BOARD OF HIGHER EDUCATION, ACTING FOR AND ON BEHALF OF THE OREGON HEALTH SCIENCES UNIVERSITY AND THE UNIVERSITY OF OREGON (US) 1998-09-01 US disclosed
EP-0805809-A2 AZA AND AZA (N-OXY) ANALOGS OF GLYCINE/NMDA RECEPTOR ANTAGONISTS State of Oregon through Oregon State Board of Higher Education for and on behalf of Oregon Health Sc. Univ. & Univ. of Oregon (US) 1997-11-12 EP disclosed
WO-1996022990-A2 AZA AND AZA (N-OXY) ANALOGS OF GLYCINE/NMDA RECEPTOR ANTAGONISTS STATE OF OREGON, acting by and through THE OREGON STATE BOARD OF HIGHER EDUCATION, acting for and onbehalf of THE OREGON HEALTH SCIENCES UNIVERSITY AND THE UNIVERSITY OF OREGON, EUGENE, OREGON (US) 1996-08-01 WO disclosed