SCHEMBL27428334

SCHEMBL27428334

O=S(=O)(O)c1cc2ccccc2c2c1C2

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 1/20 0.41
MPL P40238 8/20 0.41
CYP1A2 P05177 4/20 0.41
ALDH1A1 P00352 3/20 0.41
CTRC Q99895 2/20 0.41
HIF1A Q16665 2/20 0.41
CYP2C19 P33261 2/20 0.41
HSD17B10 Q99714 2/20 0.41
CYP2C9 P11712 2/20 0.41
ALOX15 P16050 1/20 0.41
ATIC P31939 1/20 0.41
RCE1 Q9Y256 1/20 0.40
CTRB1 P17538 1/20 0.39
TTR P02766 1/20 0.38
KDM4E B2RXH2 1/20 0.37
MEN1 O00255 1/20 0.37
GLA P06280 1/20 0.37
HPGD P15428 1/20 0.37
KMT2A Q03164 1/20 0.37
CA1 P00915 1/20 0.36

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
SCHEMBL28330344 1.00 CYP2D6 (0.41) CYP2D6MPLCYP1A2ALDH1A1CTRC
Styrene SCHEMBL28867231 0.87 CYP2D6 (0.40) CYP2D6MPLCYP1A2ALDH1A1CTRC
Styrene SCHEMBL28262220 0.85 CYP2D6 (0.39) CYP2D6MPLCYP1A2ALDH1A1CTRC
Propene SCHEMBL28262226 0.79 PPARG (0.35) CYP2D6ALDH1A1HSD17B10RCE1KDM4E
SCHEMBL390404 0.76 MPL (0.53) CYP2D6MPLCYP1A2ALDH1A1CTRC
SCHEMBL31277199 0.76 MAP3K9 (0.39) CYP2D6MPLCYP1A2ALDH1A1CTRC
SCHEMBL26634709 0.76 MAP3K9 (0.39) CYP2D6MPLCYP1A2ALDH1A1CTRC
SCHEMBL1744012 0.75 TSHR (0.46) CYP2D6MPLCYP1A2ALDH1A1CTRC
SCHEMBL11775426 0.75 MPL (0.51) CYP2D6MPLCYP1A2ALDH1A1CTRC
SCHEMBL10033897 0.73 CYP2D6 (0.51) CYP2D6MPLCYP1A2ALDH1A1CTRC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110499043-A A kind of preparation method of nano-dispersed dyestuff UNIV BEIJING CHEM TECH 2019-11-26 CN claimed
CN-110373942-A A kind of dedicated water-coal-slurry and preparation method thereof for producing black pigment 曲阜三让洁能股份有限公司 2019-10-25 CN claimed
CN-110257841-A A kind of aqueous cleaning agent and preparation method thereof 南京古田化工有限公司 2019-09-20 CN claimed
CN-109971353-A A kind of chemical mechanical polishing liquid 安集微电子(上海)有限公司 2019-07-05 CN claimed
CN-106433822-B A kind of water-coal-slurry and its pulping process of gasification of coal blending petrochemical industry waste 中国石油化工股份有限公司 2019-02-22 CN claimed
CN-108396564-A A kind of disperse type cationic dye aqueous color paste and preparation method thereof 郑州鸿盛数码科技股份有限公司 2018-08-14 CN claimed
CN-108250978-A A kind of chemical mechanical polishing liquid and its application 安集微电子科技(上海)股份有限公司 2018-07-06 CN claimed
CN-107513449-A A kind of technique of coal desulfurization before combustion 河北工程大学 2017-12-26 CN claimed
CN-107385978-A A kind of two-sided overlay film method for transfer printing 李月仙 2017-11-24 CN claimed
CN-107312358-A A kind of disperse dye composition, its preparation method and application 上海安诺其集团股份有限公司 2017-11-03 CN claimed
CN-101712895-B Compounds for fuel oil additives, preparation method and application thereof SHANGHAI BAOSTEEL CHEMICAL CO 2012-12-26 CN claimed
CN-102433777-A Cold transfer printing paste and preparation method of color paste thereof SHANGHAI NEWTECH FABRIC PRINT CO LTD 2012-05-02 CN claimed
CN-101948350-A Composite fertilizer and preparation method thereof BEIJING AGRICULTURAL COLLEGE 2011-01-19 CN claimed
CN-101941873-A Composite sterol foliage fertilizer and preparation method thereof UNIV BEIJING AGRICULT 2011-01-12 CN claimed
CN-101941872-A Pesticidal foliage fertilizer mixed with plant growth factors and preparation method thereof UNIV BEIJING AGRICULT 2011-01-12 CN claimed
CN-101935055-A Method for co-producing synthesis of ammonia through burning high-concentration waste water by using CWS (Coal Water Slurry) technology ZHEJIANG FENGDENG CHEMICAL CO LTD 2011-01-05 CN claimed
CN-101760048-A High-dispersivity fluorescent whitening agent and preparation method thereof SHANXI QINGSHAN CHEMICAL INDUS 2010-06-30 CN claimed
CN-101712895-A Compounds for fuel oil additives, preparation method and application thereof NANJING UNIVERSITY OF TECHNOLOGY 2010-05-26 CN claimed
CN-1087754-C Powdered fluorescent composition as whitening agent HUAYANG CHEMICAL CO LTD HANGZH (CN) 2002-07-17 CN claimed
CN-1298903-A Powdered fluorescent composition as whitening agent HUAYANG CHEMICAL CO LTD HANGZH (CN) 2001-06-13 CN claimed