SCHEMBL6619

SCHEMBL6619

O=[N+]([O-])c1ccc(Br)cc1F

nearest known ligand 0.64

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.64
ATM Q13315 1/20 0.64
ALDH1A1 P00352 2/20 0.47
HIF1A Q16665 1/20 0.47
S100A4 P26447 1/20 0.45
TRPV1 Q8NER1 1/20 0.45
VCAM1 P19320 1/20 0.44
AKR1C2 P52895 1/20 0.43
AKR1C1 Q04828 1/20 0.43
DGAT1 O75907 1/20 0.41
TSHR P16473 3/20 0.41
CYP3A4 P08684 1/20 0.41
MAPT P10636 2/20 0.40
PKM P14618 1/20 0.40
ESPL1 Q14674 1/20 0.40
CASP6 P55212 1/20 0.40
MAPK1 P28482 2/20 0.39
AMY1A P0DUB6 1/20 0.39
GPR35 Q9HC97 1/20 0.38

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
SCHEMBL29399835 1.00 TDP1 (0.64) TDP1ATMALDH1A1HIF1AS100A4
Ethylene SCHEMBL27608389 0.96 TDP1 (0.60) TDP1ATMALDH1A1HIF1AS100A4
SCHEMBL29172784 0.85 ATM (0.49) TDP1ATMALDH1A1HIF1AS100A4
SCHEMBL29429960 0.83 ALDH1A1 (0.62) TDP1ATMALDH1A1HIF1AS100A4
SCHEMBL40706 0.83 ALDH1A1 (0.62) TDP1ATMALDH1A1HIF1AS100A4
SCHEMBL28871017 0.81 TDP1 (0.50) TDP1ATMALDH1A1HIF1AS100A4
SCHEMBL1561802 0.80 TSHR (0.56) TDP1ATMALDH1A1S100A4TRPV1
SCHEMBL165733 0.78 CYP19A1 (0.49) TDP1ATMALDH1A1S100A4TRPV1
SCHEMBL29431838 0.78 CYP19A1 (0.49) TDP1ATMALDH1A1S100A4TRPV1
SCHEMBL29385912 0.78 TDP1 (1.00) TDP1ATMALDH1A1HIF1AVCAM1

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

Appears in 2160 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115124470-B Method for preparing sulfonamide structured kinase inhibitors 奥瑞基尼肿瘤有限公司 2024-08-27 CN claimed
CN-116854670-A Dihydroquinoxaline selective bromodomain recognition protein inhibitor, and preparation method and application thereof 中国科学院上海药物研究所 2023-10-10 CN claimed
EP-4137487-A1 PROCESS FOR THE PREPARATION OF A SULFONAMIDE STRUCTURED KINASE INHIBITOR Aurigene Discovery Technologies Limited (IN) 2023-02-22 EP claimed
EP-3601262-B1 PROCESS FOR THE PREPARATION OF A SULFONAMIDE STRUCTURED KINASE INHIBITOR AURIGENE DISCOVERY TECH LTD (IN) 2022-11-09 EP claimed
CN-110446704-B Process for the preparation of sulfonamide-structured kinase inhibitors 奥赖恩公司 2022-07-05 CN claimed
US-11332460-B2 Process for the preparation of a sulfonamide structured kinase inhibitor ORION CORPORATION (FI) 2022-05-17 US claimed
US-20210139462-A1 PROCESS FOR THE PREPARATION OF A SULFONAMIDE STRUCTURED KINASE INHIBITOR AURIGENE ONCOLOGY LIMITED (IN) 2021-05-13 US claimed
US-10870637-B2 Process for the preparation of a sulfonamide structured kinase inhibitor ORION CORPORATION (FI) 2020-12-22 US claimed
CN-110551101-B 1. 6-disubstituted-benzo five-membered heterocyclic derivative and application thereof 沈阳药科大学 2020-11-24 CN claimed
US-20200102291-A1 PROCESS FOR THE PREPARATION OF A SULFONAMIDE STRUCTURED KINASE INHIBITOR AURIGENE ONCOLOGY LIMITED (IN) 2020-04-02 US claimed
CN-109354569-A A kind of preparation method of the bromo- 4- fluorobenzene of 1,3- bis- 常州大学 2019-02-19 CN claimed
WO-2018172616-A1 PROCESS FOR THE PREPARATION OF A SULFONAMIDE STRUCTURED KINASE INHIBITOR ORION CORPORATION (FI) 2018-09-27 WO claimed
CN-108126656-A For the modified activated carbon absorbent of benzene in Adsorption wastewater from chemical industry 北京益清源环保科技有限公司 2018-06-08 CN claimed
US-20160362382-A1 BENZAMIDE DERIVATIVES TRANSLATIONAL DRUG DEVELOPMENT, LLC 2016-12-15 US claimed
US-9464059-B2 Benzamide derivatives THE TRANSLATIONAL GENOMICS RESEARCH INSTITUTE (US) 2016-10-11 US claimed
US-20150284336-A1 BENZAMIDE DERIVATIVES TRANSLATIONAL DRUG DEVELOPMENT, LLC 2015-10-08 US claimed
EP-2445345-B1 BENZAMIDE DERIVATIVES TRANSLATIONAL GENOMICS RES INST (US) 2014-08-27 EP claimed
US-20120142922-A1 BENZAMIDE DERIVATIVES TRANSLATIONAL GENOMICS RESEARCH INSTITUTE (US) 2012-06-07 US claimed
EP-2445345-A1 BENZAMIDE DERIVATIVES The Translational Genomics Research Institute (US) 2012-05-02 EP claimed
WO-2010151441-A1 BENZAMIDE DERIVATIVES TRANSLATIONAL GENOMICS RESEARCH INSTITUTE (US) 2010-12-29 WO claimed