SCHEMBL1694705

SCHEMBL1694705

O=C(c1ccccc1)c1cccc([N+](=O)[O-])c1[N+](=O)[O-]

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR35 Q9HC97 2/20 0.51
ALDH1A1 P00352 4/20 0.51
TSHR P16473 3/20 0.50
MAPK1 P28482 2/20 0.49
VCAM1 P19320 1/20 0.49
AKR1C3 P42330 1/20 0.47
CTSD P07339 1/20 0.46
MAPT P10636 4/20 0.46
GAA P10253 3/20 0.46
KDM4E B2RXH2 3/20 0.46
POLB P06746 2/20 0.46
HTT P42858 2/20 0.46
HPGD P15428 2/20 0.46
TDP1 Q9NUW8 2/20 0.46
CDC25B P30305 1/20 0.46
MAOB P27338 1/20 0.45
LMNA P02545 2/20 0.45
GLA P06280 1/20 0.45
MEN1 O00255 1/20 0.44
GMNN O75496 1/20 0.44

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
Glycine SCHEMBL28091349 0.91 CTSD (0.47) GPR35ALDH1A1TSHRMAPK1VCAM1
SCHEMBL8962721 0.90 GPR35 (0.51) GPR35ALDH1A1TSHRMAPK1VCAM1
SCHEMBL11107590 0.88 MAPK1 (0.54) GPR35ALDH1A1MAPK1VCAM1AKR1C3
SCHEMBL7417028 0.88 GPR35 (0.60) GPR35ALDH1A1TSHRCTSDTDP1
SCHEMBL27637513 0.86 ALDH1A1 (0.59) ALDH1A1TSHRMAPK1VCAM1AKR1C3
SCHEMBL411359 0.86 ALDH1A1 (0.59) ALDH1A1TSHRMAPK1VCAM1AKR1C3
Benzoic Acid SCHEMBL8610843 0.85 TSHR (0.57) GPR35ALDH1A1TSHRCTSDMAPT
SCHEMBL10613868 0.85 CES2 (0.57) GPR35ALDH1A1TSHRCTSDMAPT
SCHEMBL2837830 0.85 GPR35 (0.53) GPR35ALDH1A1TSHRMAPK1CTSD
SCHEMBL28783981 0.84 ALDH1A1 (0.58) ALDH1A1TSHRMAPK1VCAM1AKR1C3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109400481-B Method for synthesizing 3,3' -diaminobenzophenone by one-pot method 宏威高新材料有限公司 2021-11-30 CN claimed
CN-106748836-A Aryl benzophenone cpd of 3,5 diaminourea 4 ' and preparation method thereof 江苏爱姆欧光电材料有限公司 2017-05-31 CN claimed
EP-1437749-B1 ELECTROLYTE SOLUTION FOR DRIVING ELECTROLYTIC CAPACITOR AND ELECTROLYTIC CAPACITOR RUBYCON CORP (JP) 2013-07-17 EP claimed
US-7539006-B2 Electrolytic solution for driving electrolytic capacitor and electrolytic capacitor RUBYCON CORPORATION (JP) 2009-05-26 US claimed
CN-100456398-C Electrolyte for driving electrolytic capacitor and electrolytic capacitor RUBYCON CORP (JP) 2009-01-28 CN claimed
US-20070029529-A1 Electrolytic solution for driving electrolytic capacitor and electrolytic capacitor KOMATSU AKIHIKO 2007-02-08 US claimed
US-20040245105-A1 Electrolyte solution for driving electrolytic capacitor and electrolytic capacitor RUBYCON CORPORATION (JP) 2004-12-09 US claimed
CN-1529892-A Electrolyte for driving electrolytic capacitor and electrolytic capacitor 如碧空株式会社 2004-09-15 CN claimed
EP-1437749-A1 ELECTROLYTE SOLUTION FOR DRIVING ELECTROLYTIC CAPACITOR AND ELECTROLYTIC CAPACITOR Rubycon Corporation (JP) 2004-07-14 EP claimed
EP-0098677-B1 PROCESS FOR PREPARING DINITROBENZOPHENONES CHEVRON RESEARCH COMPANY (US) 1989-06-14 EP claimed
EP-0098681-B1 NOVEL DINITROBENZOPHENONE SOLUTION AND PROCESS FOR PREPARING AN ETHER SOLUTION OF DIAMINOBENZOPHENONES THEREFROM CHEVRON RESEARCH COMPANY (US) 1988-08-17 EP claimed
EP-0226637-A1 CHAIN-EXTENDED POLY(ARYL ETHER KETONES) AMOCO CORPORATION (US) 1987-07-01 EP claimed
WO-1986007368-A1 CHAIN-EXTENDED POLY(ARYL ETHER KETONES) AMOCO CORPORATION (US) 1986-12-18 WO claimed
US-4560721-A HYDROGENATION DINITROBENZOPHENONE, REACTRING WITH AROMATIC DIANHYDRIDE GULF RESEARCH & DEVELOPMENT COMPANY (US) 1985-12-24 US claimed
US-4560800-A REACTING BENZOPHENONE WITH NITRIC ACID IN OLEUM, ADJUSTMENT OF WATER CONTENT, AND SOLVENT EXTRACTION WITH CHLORINATED HYDROCARBON GULF RESEARCH & DEVELOPMENT CO. (US) 1985-12-24 US claimed
US-4540818-A Process for preparation of 3,3'- or 3,4'-diaminodiphenylmethane MITSUI TOATSU CHEMICALS, INC. (JP) 1985-09-10 US claimed
US-4474989-A Process for preparing dinitrobenzophenones GULF RESEARCH & DEVELOPMENT COMPANY (US) 1984-10-02 US claimed
EP-0098677-A2 Process for preparing dinitrobenzophenones CHEVRON RESEARCH COMPANY (US) 1984-01-18 EP claimed
EP-0098681-A2 Novel dinitrobenzophenone solution and process for preparing an ether solution of diaminobenzophenones therefrom CHEVRON RESEARCH COMPANY (US) 1984-01-18 EP claimed
US-4352942-A TREATMENT OF ISOMERIC MIXTURE OF NITRO AROMATIC KETO COMPOUNDS WITH OLEUM GULF RESEARCH & DEVELOPMENT COMPANY (US) 1982-10-05 US claimed