SCHEMBL975118

SCHEMBL975118

O=C(c1ccc([N+](=O)[O-])cc1)c1ccc([N+](=O)[O-])cc1

nearest known ligand 0.83

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SRD5A2 P31213 2/20 0.83
LMNA P02545 1/20 0.80
GAA P10253 1/20 0.80
L3MBTL1 Q9Y468 1/20 0.77
MAPK1 P28482 2/20 0.74
POLB P06746 1/20 0.74
CES1 P23141 2/20 0.74
CA1 P00915 3/20 0.71
CA2 P00918 3/20 0.71
TDP1 Q9NUW8 2/20 0.71
ALDH1A1 P00352 2/20 0.69
MAPT P10636 1/20 0.69
TSHR P16473 1/20 0.68
CA12 O43570 1/20 0.65
CA9 Q16790 1/20 0.65
CA14 Q9ULX7 1/20 0.65
CES2 O00748 1/20 0.63
GSK3B P49841 1/20 0.61

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
SCHEMBL10723714 1.00 SRD5A2 (0.83) SRD5A2LMNAGAAL3MBTL1MAPK1
SCHEMBL28914440 0.93 MAPK1 (0.85) SRD5A2LMNAGAAL3MBTL1MAPK1
SCHEMBL4249231 0.91 SRD5A2 (1.00) SRD5A2LMNAGAAL3MBTL1MAPK1
SCHEMBL4686670 0.91 SRD5A2 (0.71) SRD5A2LMNAGAAL3MBTL1MAPK1
SCHEMBL229627 0.91 POLB (0.82) SRD5A2LMNAGAAL3MBTL1MAPK1
Benzophenone SCHEMBL28231509 0.91 POLB (0.82) SRD5A2LMNAGAAL3MBTL1MAPK1
SCHEMBL9189648 0.89 LMNA (0.72) SRD5A2LMNAGAAL3MBTL1MAPK1
SCHEMBL1979491 0.89 POLB (0.71) SRD5A2LMNAGAAL3MBTL1MAPK1
SCHEMBL1642912 0.89 SRD5A2 (0.69) SRD5A2LMNAGAAL3MBTL1MAPK1
SCHEMBL9137646 0.89 SRD5A2 (0.69) SRD5A2LMNAGAAL3MBTL1MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116426113-B High-compression-resistance fiber-reinforced polyurethane composite board and preparation method thereof 浙江恒亿达复合材料有限公司 2024-02-27 CN claimed
CN-116426113-A High-compression-resistance fiber-reinforced polyurethane composite board and preparation method thereof 浙江恒亿达复合材料有限公司 2023-07-14 CN claimed
CN-113025033-B Modified foamed polyurethane film material and preparation method thereof 常州宏巨电子科技有限公司 2022-05-17 CN claimed
CN-113185540-A Red electroluminescent micromolecule and preparation method thereof 广州万物物联科技有限公司 2021-07-30 CN claimed
CN-113122239-A Phenanthroimidazole-based red light electroluminescent material and preparation method thereof 广州万物物联科技有限公司 2021-07-16 CN claimed
CN-113025033-A Modified foamed polyurethane film material and preparation method thereof 常州宏巨电子科技有限公司 2021-06-25 CN claimed
CN-109516956-A 5- pyrazoles first ketone compounds and its application 湖南新长山农业发展股份有限公司 2019-03-26 CN claimed
CN-104119285-A Compound used as estrogen-related receptor regulator and application of compound GUANGZHOU INST BIOMED & HEALTH 2014-10-29 CN claimed
CN-102356066-A Novel 2,6-substituted-3-nitropyridine derivative, method for preparing same, and pharmaceutical composition including same DONG WHA PHARM CO LTD 2012-02-15 CN claimed
CN-101175728-B Process for the preparation of a carboxamide derivative BAYER CROPSCIENCE AG 2011-05-18 CN claimed
CN-101175728-A Process for the preparation of a carboxamide derivative BAYER CROPSCIENCE SA (FR) 2008-05-07 CN claimed
EP-1881963-A1 PROCESS FOR THE PREPARATION OF A CARBOXAMIDE DERIVATIVE Bayer CropScience S.A. (FR) 2008-01-30 EP claimed
WO-2006120031-A1 PROCESS FOR THE PREPARATION OF A CARBOXAMIDE DERIVATIVE BAYER CROPSCIENCE S.A. (FR) 2006-11-16 WO claimed
EP-1721899-A1 Process for the preparation of a carboxamide derivative Bayer CropScience S.A. (FR) 2006-11-15 EP claimed
EP-0577945-B1 Herbicide intermediate o-nitrophenyl cyclopropyl ketone and a method for the preparation thereof AMERICAN CYANAMID CO (US) 1996-08-14 EP claimed
US-5364968-A Herbicide intermediate o-nitrophenyl cyclopropyl ketone and a method for the preparation thereof AMERICAN CYANAMID COMPANY (US) 1994-11-15 US claimed
EP-0577945-A1 Herbicide intermediate o-nitrophenyl cyclopropyl ketone and a method for the preparation thereof AMERICAN CYANAMID COMPANY (US) 1994-01-12 EP claimed
EP-0542836-A1 POLYMERIZATION OF SELECTED VINYL MONOMERS. DU PONT (US) 1993-05-26 EP claimed
US-5030704-A Self polymerizable phenylquinoxalines, their preparation and use in polyphenylquinoxaline homopolymers and copolymers THE UNIVERSITY OF AKRON (US) 1991-07-09 US claimed
WO-1990015836-A1 SELF-POLYMERIZABLE PHENYLQUINOXALINES THE UNIVERSITY OF AKRON (US) 1990-12-27 WO claimed