SCHEMBL2402265

SCHEMBL2402265

C=Cc1cccc(Br)c1[N+](=O)[O-]

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.41
LMNA P02545 2/20 0.41
HSP90AA1 P07900 1/20 0.41
MAPT P10636 1/20 0.41
ATM Q13315 1/20 0.41
TDP1 Q9NUW8 3/20 0.39
PMM2 O15305 1/20 0.38
MPI P34949 1/20 0.38
ERN1 O75460 1/20 0.36
TSHR P16473 2/20 0.35
GPR35 Q9HC97 2/20 0.35
TYMS P04818 1/20 0.33
SOS1 Q07889 1/20 0.33
CYP3A4 P08684 1/20 0.32
XDH P47989 1/20 0.32
RXRA P19793 1/20 0.32
S100A4 P26447 1/20 0.32
HSD11B1 P28845 1/20 0.32
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31

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
SCHEMBL16956334 0.86 ALDH1A1 (0.46) ALDH1A1LMNAMAPTTDP1ERN1
SCHEMBL27123376 0.83 TYMS (0.39) ALDH1A1LMNAHSP90AA1MAPTATM
SCHEMBL2625726 0.83 ERN1 (0.49) ALDH1A1LMNAHSP90AA1MAPTATM
SCHEMBL16958093 0.81 ALDH1A1 (0.41) ALDH1A1LMNAHSP90AA1MAPTATM
SCHEMBL16961852 0.81 ALDH1A1 (0.39) ALDH1A1LMNAHSP90AA1MAPTATM
SCHEMBL9452627 0.80 ALDH1A1 (0.52) ALDH1A1LMNATDP1PMM2MPI
SCHEMBL5211004 0.79 ERN1 (0.49) ALDH1A1LMNAMAPTTDP1ERN1
SCHEMBL9422617 0.79 GPR35 (0.53) ALDH1A1MAPTTDP1ERN1TSHR
SCHEMBL11048252 0.78 MEN1 (0.40) ALDH1A1LMNAMAPTTDP1ERN1
SCHEMBL31023003 0.78 ALDH1A1 (0.39) ALDH1A1LMNAMAPTATMTDP1

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 22 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1480664-A2 COMPOSITIONS AND METHODS OF USE OF PEPTIDES IN COMBINATION WITH BIOCIDES AND/OR GERMICIDES Arizona State University (US) 2004-12-01 EP claimed
WO-2003091276-A2 COMPOSITIONS AND METHODS OF USE OF PEPTIDES IN COMBINATION WITH BIOCIDES AND/OR GERMICIDES HERCULES INCORPORATED (US) 2003-11-06 WO claimed
CN-1316979-A Method of controlling biofouling in aqueous media using antimicrobial emulsions NALCO CHEMICAL CO (US) 2001-10-10 CN claimed
US-5256419-A Biological & dust control methods for bulk/granular solids BETZ LABORATORIES, INC. (US) 1993-10-26 US claimed
JP-4290865-A None JP disclosed
US-20200095410-A1 POLYOLEFIN RESIN COMPOSITION, MOLDING, AND POLYOLEFIN RESIN FILM NATIONAL UNIVERSITY CORPORATION KANAZAWA UNIVERSITY (JP) 2020-03-26 US disclosed
EP-3187533-B1 POLYOLEFIN RESIN COMPOSITION, MOLDING, AND POLYOLEFIN RESIN FILM UNIV NAT CORP KANAZAWA (JP) 2019-02-20 EP disclosed
US-20170253733-A1 POLYOLEFIN RESIN COMPOSITION, MOLDING, AND POLYOLEFIN RESIN FILM NATIONAL UNIVERSITY CORPORATION KANAZAWA UNIVERSITY (JP) 2017-09-07 US disclosed
EP-3187533-A1 POLYOLEFIN RESIN COMPOSITION, MOLDING, AND POLYOLEFIN RESIN FILM National University Corporation Kanazawa University (JP) 2017-07-05 EP disclosed
EP-2954019-A2 ANTIMICROBIAL ADHESIVES HAVING IMPROVED PROPERTIES Avery Dennison Corporation (US) 2015-12-16 EP disclosed
EP-2900645-A1 3-PHENYLISOXAZOLIN DERIVATIVES WITH HERBICIDAL ACTION Bayer CropScience AG (DE) 2015-08-05 EP disclosed
WO-2014124232-A2 ANTIMICROBIAL ADHESIVES HAVING IMPROVED PROPERTIES AVERY DENNISON CORPORATION (US) 2014-08-14 WO disclosed
CN-1316979-A Method of controlling biofouling in aqueous media using antimicrobial emulsions NALCO CHEMICAL CO (US) 2001-10-10 CN disclosed
EP-0487870-B1 Insecticidal and acaricidal diarylpyrrolecarbonitrile and diarylnitropyrrole compounds AMERICAN CYANAMID CO (US) 1996-12-18 EP disclosed
US-5500220-A FOAM, ACROLEIN BETZ LABORATORIES, INC. (US) 1996-03-19 US disclosed
US-5256419-A Biological & dust control methods for bulk/granular solids BETZ LABORATORIES, INC. (US) 1993-10-26 US disclosed
US-5233052-A Insecticidal and acaricidal diarylpyrrolecarbonitrile and diarylnitropyrrole compounds AMERICAN CYANAMID COMPANY (US) 1993-08-03 US disclosed
US-5180734-A INSECTICIDAL AND ACARICIDAL DIARYLPYRROLECARBONITRILE AND DIARYLNITROPYRROLE COMPOUNDS AMERICAN CYANAMID COMPANY (US) 1993-01-19 US disclosed
JP-H04290865-A INSECTICIDAL AND MITICIDAL DIARYLPYRROLECARBONITRILE AND DIARYLNITROPYRROLE COMPOUND AMERICAN CYANAMID CO 1992-10-15 JP disclosed
EP-0487870-A2 Insecticidal and acaricidal diarylpyrrolecarbonitrile and diarylnitropyrrole compounds AMERICAN CYANAMID COMPANY (US) 1992-06-03 EP disclosed