SCHEMBL8065690

SCHEMBL8065690

CNc1ccc([N+](=O)[O-])c(O)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR35 Q9HC97 3/20 0.56
ALDH1A1 P00352 4/20 0.50
HSD17B10 Q99714 3/20 0.50
RECQL P46063 2/20 0.50
HTT P42858 1/20 0.47
SIRT6 Q8N6T7 1/20 0.46
CTSB P07858 1/20 0.46
MAPT P10636 3/20 0.44
HPGD P15428 3/20 0.44
CYP3A4 P08684 3/20 0.44
LMNA P02545 2/20 0.44
POLB P06746 2/20 0.44
KDM4E B2RXH2 1/20 0.44
CYP1A2 P05177 1/20 0.44
CYP2C9 P11712 1/20 0.44
BLM P54132 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
ALDH5A1 P51649 1/20 0.43
ABAT P80404 1/20 0.43
TSHR P16473 3/20 0.43

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
Hydrochloric Acid SCHEMBL28214254 0.98 GPR35 (0.55) GPR35ALDH1A1HSD17B10RECQLHTT
SCHEMBL9148689 0.86 GPR35 (0.53) GPR35ALDH1A1HSD17B10RECQLHTT
SCHEMBL7082579 0.85 ALDH1A1 (0.56) GPR35ALDH1A1HSD17B10RECQLHTT
SCHEMBL27039902 0.82 ALDH1A1 (0.55) ALDH1A1HSD17B10RECQLHTTMAPT
SCHEMBL9297681 0.81 GPR35 (0.56) GPR35ALDH1A1HSD17B10RECQLSIRT6
SCHEMBL358355 0.81 HTT (0.63) GPR35ALDH1A1HTTMAPTLMNA
SCHEMBL8616062 0.79 MAPT (0.55) ALDH1A1HSD17B10RECQLHTTMAPT
SCHEMBL9136568 0.79 ALDH1A1 (0.64) ALDH1A1HSD17B10RECQLHTTMAPT
SCHEMBL13548441 0.78 TDP1 (0.58) ALDH1A1HSD17B10RECQLHTTSIRT6
SCHEMBL30726456 0.78 TDP1 (0.58) ALDH1A1HSD17B10RECQLHTTSIRT6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105992970-A Liquid crystal display device having a plurality of pixel electrodes DIC株式会社 2016-10-05 CN disclosed
EP-0706551-B1 POLYALKYL HYDROXY AND AMINO AROMATIC CARBAMATES AND FUEL COMPOSITIONS CONTAINING THE SAME CHEVRON CHEM CO (US) 2000-06-07 EP disclosed
EP-0706554-B1 POLY(OXYALKYLENE) HYDROXY AND AMINO AROMATIC CARBAMATES AND FUEL COMPOSITIONS CONTAINING THE SAME CHEVRON CHEM CO (US) 2000-06-07 EP disclosed
EP-0706551-A4 POLYALKYL HYDROXY AND AMINO AROMATIC CARBAMATES AND FUEL COMPOSITIONS CONTAINING THE SAME CHEVRON CHEM CO (US) 1996-09-18 EP disclosed
EP-0706554-A4 POLY(OXYALKYLENE) HYDROXY AND AMINO AROMATIC CARBAMATES AND FUEL COMPOSITIONS CONTAINING THE SAME CHEVRON CHEM CO (US) 1996-09-18 EP disclosed
EP-0706551-A1 POLYALKYL HYDROXY AND AMINO AROMATIC CARBAMATES AND FUEL COMPOSITIONS CONTAINING THE SAME CHEVRON CHEMICAL COMPANY (US) 1996-04-17 EP disclosed
EP-0706554-A1 POLY(OXYALKYLENE) HYDROXY AND AMINO AROMATIC CARBAMATES AND FUEL COMPOSITIONS CONTAINING THE SAME CHEVRON CHEMICAL COMPANY (US) 1996-04-17 EP disclosed
US-5484463-A Poly(oxyalkylene) hydroxy and amino aromatic carbamates and fuel compositions containing the same CHEVRON CHEMICAL COMPANY (US) 1996-01-16 US disclosed
WO-1995029972-A1 POLYALKYL HYDROXY AND AMINO AROMATIC CARBAMATES AND FUEL COMPOSITIONS CONTAINING THE SAME CHEVRON CHEMICAL COMPANY (US) 1995-11-09 WO disclosed
WO-1995029975-A1 POLY(OXYALKYLENE) HYDROXY AND AMINO AROMATIC CARBAMATES AND FUEL COMPOSITIONS CONTAINING THE SAME CHEVRON CHEMICAL COMPANY (US) 1995-11-09 WO disclosed
US-5413615-A Fuel additives, antideposit CHEVRON CHEMICAL COMPANY (US) 1995-05-09 US disclosed
US-4417896-A NITRO-,AMINO-,PHENOXYALKANOLS SOCIETE ANONYME DITE: L'OREAL (FR) 1983-11-29 US disclosed
US-4337061-A NITRO DYES IN AQUEOUS SOLUTION SOCIETE ANONYME DITE: L'OREAL (FR) 1982-06-29 US disclosed