SCHEMBL8045359

SCHEMBL8045359

O=[N+]([O-])c1ccccc1N=Nc1ccc(Nc2ccccc2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.53
L3MBTL1 Q9Y468 3/20 0.53
MAPK1 P28482 3/20 0.53
TDP1 Q9NUW8 3/20 0.53
CASP7 P55210 1/20 0.53
HPGD P15428 1/20 0.51
ALOX12 P18054 1/20 0.51
MEN1 O00255 6/20 0.47
KMT2A Q03164 6/20 0.47
MAPT P10636 3/20 0.47
RAB9A P51151 3/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
CASP3 P42574 1/20 0.47
SENP8 Q96LD8 1/20 0.47
SENP7 Q9BQF6 1/20 0.47
SENP6 Q9GZR1 1/20 0.47
CYP3A4 P08684 1/20 0.46
TSHR P16473 1/20 0.46
HTT P42858 1/20 0.46
HSD17B10 Q99714 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
SCHEMBL1263553 0.85 PLAU (0.53) ALDH1A1L3MBTL1MAPK1TDP1CASP7
SCHEMBL1263552 0.85 PLAU (0.53) ALDH1A1L3MBTL1MAPK1TDP1CASP7
Charcoal, Activated SCHEMBL5133893 0.84 PLAU (0.51) ALDH1A1L3MBTL1MAPK1TDP1CASP7
SCHEMBL29190931 0.83 ALDH1A1 (0.49) ALDH1A1L3MBTL1MAPK1TDP1MEN1
SCHEMBL2302235 0.81 HPGD (0.79) ALDH1A1L3MBTL1MAPK1TDP1HPGD
SCHEMBL769328 0.81 HPGD (0.79) ALDH1A1L3MBTL1MAPK1TDP1HPGD
SCHEMBL23833678 0.80 PLAU (0.47) ALDH1A1L3MBTL1TDP1MEN1KMT2A
SCHEMBL11456229 0.80 CCNT1 (0.54) ALDH1A1L3MBTL1MAPK1TDP1MEN1
SCHEMBL11217415 0.80 IDE (0.53) ALDH1A1MAPK1TDP1HPGDMEN1
SCHEMBL11456230 0.80 CCNT1 (0.54) ALDH1A1L3MBTL1MAPK1TDP1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0726889-B1 PROCESS FOR PREPARING SUBSTITUTED AROMATIC AMINES MONSANTO CO (US) 2000-04-12 EP disclosed
EP-0696269-B1 PROCESS FOR PREPARING SUBSTITUTED AROMATIC AMINES MONSANTO CO (US) 1999-06-30 EP disclosed
US-5633407-A Process for preparing substituted aromatic amines FLEXSYS AMERICA L. P. (US) 1997-05-27 US disclosed
US-5618979-A REACTING NUCLEOPHILIC AMINE AND AMIDE WITH SUBSTITUTED AROMATIC AZO COMPOUND OR AZOXY OR HYDRAZINO COMPOUND FLEXSYS AMERICA L. P. (US) 1997-04-08 US disclosed
EP-0641313-B1 PROCESS FOR PREPARING SUBSTITUTED AROMATIC AMINES MONSANTO CO (US) 1997-01-22 EP disclosed
US-5552531-A USED IN THE PRODUCTION OF AROMATIC AMINES, REACTING A NUCLEOPHILIC ANILINE, OR AMIDE OR AMINE WITH AN AZO COMPOUND MONSANTO COMPANY (US) 1996-09-03 US disclosed
EP-0726889-A1 PROCESS FOR PREPARING SUBSTITUTED AROMATIC AMINES MONSANTO COMPANY (US) 1996-08-21 EP disclosed
EP-0696269-A1 PROCESS FOR PREPARING SUBSTITUTED AROMATIC AMINES MONSANTO COMPANY (US) 1996-02-14 EP disclosed
US-5451702-A Process for preparing substituted aromatic amines MONSANTO COMPANY (US) 1995-09-19 US disclosed
WO-1995012569-A1 PROCESS FOR PREPARING SUBSTITUTED AROMATIC AMINES MONSANTO COMPANY (US) 1995-05-11 WO disclosed
EP-0641313-A1 PROCESS FOR PREPARING SUBSTITUTED AROMATIC AMINES. MONSANTO CO (US) 1995-03-08 EP disclosed
US-5382691-A Process for preparing substituted aromatic amines MONSANTO COMPANY (US) 1995-01-17 US disclosed
WO-1994025425-A1 PROCESS FOR PREPARING SUBSTITUTED AROMATIC AMINES MONSANTO COMPANY (US) 1994-11-10 WO disclosed
WO-1993024450-A1 PROCESS FOR PREPARING SUBSTITUTED AROMATIC AMINES MONSANTO COMPANY (US) 1993-12-09 WO disclosed