SCHEMBL6368

SCHEMBL6368

O=[N+]([O-])c1ccc(F)cc1Cl

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.64
TSHR P16473 1/20 0.64
MAPK1 P28482 1/20 0.64
ATM Q13315 1/20 0.64
CA1 P00915 1/20 0.50
CA2 P00918 1/20 0.50
MMP1 P03956 1/20 0.50
MMP2 P08253 1/20 0.50
MMP9 P14780 1/20 0.50
MMP8 P22894 1/20 0.50
MMP13 P45452 1/20 0.50
ALDH1A1 P00352 3/20 0.49
HTT P42858 2/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
PDE7A Q13946 2/20 0.49
F2 P00734 2/20 0.46
PRSS1 P07477 2/20 0.46
PRSS2 P07478 2/20 0.46
PRSS3 P35030 2/20 0.46

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
SCHEMBL29537379 1.00 TDP1 (0.64) TDP1TSHRMAPK1ATMCA1
Fluoride SCHEMBL27762448 0.98 TDP1 (0.62) TDP1TSHRMAPK1ATMCA1
SCHEMBL3983637 0.91 TDP1 (0.55) TDP1TSHRMAPK1ATMCA1
SCHEMBL29563244 0.83 TDP1 (0.59) TDP1TSHRMAPK1ATMALDH1A1
SCHEMBL687212 0.83 TDP1 (0.59) TDP1TSHRMAPK1ATMALDH1A1
SCHEMBL5857100 0.81 PDE7A (0.72) TDP1TSHRMAPK1ATMCA1
SCHEMBL29745239 0.80 TDP1 (0.72) TDP1TSHRMAPK1ATMALDH1A1
SCHEMBL216553 0.80 TDP1 (0.72) TDP1TSHRMAPK1ATMALDH1A1
SCHEMBL29385912 0.78 TDP1 (1.00) TDP1TSHRMAPK1ATMALDH1A1
SCHEMBL57112 0.78 TDP1 (1.00) TDP1TSHRMAPK1ATMALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115582144-B Hierarchical pore covalent organic framework-metal composite structure catalyst and preparation method and application thereof 浙江工业大学 2024-01-16 CN claimed
CN-116351100-A System and method for extracting nitro reaction product by supercritical carbon dioxide 天津凯莱英医药科技发展有限公司 2023-06-30 CN claimed
CN-115582144-A Hierarchical pore covalent organic framework-metal composite structure catalyst and preparation method and application thereof 浙江工业大学 2023-01-10 CN claimed
CN-107311869-B The preparation method of 3,4,5- trifluoronitrobenzene 浙江解氏新材料股份有限公司 2019-11-08 CN claimed
CN-108997135-A A kind of method and device producing the chloro- 4- fluoroaniline of 3- 张金河 2018-12-14 CN claimed
CN-106316861-B A kind of method for preparing double benzene bacterium amine 沈阳中化农药化工研发有限公司 2018-04-24 CN claimed
CN-107325001-A The preparation method of 2,3,4 trifluoronitrobenzenes 浙江解氏新材料股份有限公司 2017-11-07 CN claimed
CN-107311869-A The preparation method of 3,4,5 trifluoronitrobenzenes 浙江解氏新材料股份有限公司 2017-11-03 CN claimed
CN-106631811-A Preparation method of 3-chloro-4-fluoronitrobenzene 山东友帮生化科技有限公司 2017-05-10 CN claimed
CN-104741148-B Method for preparing 3-chlorine-4 fluoronitrobenzene hydrogenation catalyst 浙江衢州万能达科技有限公司 2017-02-08 CN claimed
CN-103709044-A Preparation method of 3-chloro-4-fluoroaniline hydrochloride JIANGSU JIXIAN GREEN CHEMICAL TECHNOLOGY RES INST CO LTD 2014-04-09 CN claimed
CN-103420842-A Preparation method for 2,3,4-trifluoronitrobenzene SHANGYU LINJIANG CHEMICAL CO LTD 2013-12-04 CN claimed
CN-102617360-B Synthetic method of 3, 5-dichloro-2, 4-difluoroaniline JIANGXI JIXIANG PHARMACEUTICAL CO LTD 2013-11-06 CN claimed
CN-102911080-A Method for preparing 2,6-dichloro-alpha-(4-chlorphenyl)-4-nitro phenylacetonitrile UNIV QUZHOU 2013-02-06 CN claimed
CN-101624348-B Preparation method of para-fluoroaniline UNIV ZHEJIANG 2013-01-02 CN claimed
CN-102617360-A Synthetic method of 3, 5-dichloro-2, 4-difluoroaniline JIANGXI JIXIANG PHARMACEUTICAL CO LTD 2012-08-01 CN claimed
CN-101624348-A Preparation method of para-fluoroaniline UNIV ZHEJIANG 2010-01-13 CN claimed
CN-101337862-A Method for preparing 2,3-dichlorin fluorobenzene ZHEJIANG FUSHENG HOLDING GROUP (CN) 2009-01-07 CN claimed
CN-101177379-A Method for preparing 2,4,6-trichloro-fluorobenzene ZHEJIANG FUSHENG HOLDING GROUP (CN) 2008-05-14 CN claimed
CN-1044899-C Synthetic process of 2,4-fluobenzene dichloride UNIV ZHEJIANG (CN) 1999-09-01 CN claimed