SCHEMBL3144362

SCHEMBL3144362

O=C(O)C=CCC(c1ccccc1)c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 3/20 0.44
CYP2C19 P33261 4/20 0.44
HDAC3 O15379 1/20 0.43
TNKS O95271 1/20 0.43
HDAC4 P56524 1/20 0.43
HDAC1 Q13547 1/20 0.43
HDAC7 Q8WUI4 1/20 0.43
HDAC2 Q92769 1/20 0.43
HDAC10 Q969S8 1/20 0.43
HDAC11 Q96DB2 1/20 0.43
HDAC8 Q9BY41 1/20 0.43
TNKS2 Q9H2K2 1/20 0.43
HDAC6 Q9UBN7 1/20 0.43
HDAC9 Q9UKV0 1/20 0.43
HDAC5 Q9UQL6 1/20 0.43
CYP2D6 P10635 2/20 0.41
SRC P12931 1/20 0.41
LMNA P02545 5/20 0.41
ALDH1A1 P00352 4/20 0.41
KDM4E B2RXH2 2/20 0.41

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
SCHEMBL7239259 1.00 HCAR2 (0.44) HCAR2CYP2C19HDAC3TNKSHDAC4
SCHEMBL7238650 1.00 HCAR2 (0.44) HCAR2CYP2C19HDAC3TNKSHDAC4
SCHEMBL17460171 0.86 GABBR2 (0.44) HCAR2CYP2C19HDAC3TNKSHDAC4
SCHEMBL9380747 0.83 HCAR2 (0.42) HCAR2CYP2C19HDAC3TNKSHDAC4
SCHEMBL17730952 0.82 CYP2C19 (0.62) HCAR2CYP2C19HDAC3TNKSHDAC4
SCHEMBL7374430 0.82 HCAR2 (0.49) HCAR2CYP2C19KDM4ECYP3A4RAB9A
SCHEMBL17730949 0.82 CYP2C19 (0.62) HCAR2CYP2C19HDAC3TNKSHDAC4
SCHEMBL5744606 0.82 HCAR2 (0.45) HCAR2CYP2C19HDAC3TNKSHDAC4
SCHEMBL17730856 0.81 GABBR2 (0.41) HCAR2CYP2C19HDAC3TNKSHDAC4
SCHEMBL17730855 0.81 GABBR2 (0.41) HCAR2CYP2C19HDAC3TNKSHDAC4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109206433-A The preparation and the application in personal care product of bitter beans ketone 云白药征武科技(上海)有限公司 2019-01-15 CN claimed
CN-107126660-A A kind of composition for including fluorinated ketones contained 中化蓝天集团有限公司 2017-09-05 CN claimed
CN-107082963-A One kind is low to distribute TVOC expanded polypropylene products and preparation method thereof 成都硕屋科技有限公司 2017-08-22 CN claimed
CN-104672107-A A preparing method of ethyl 2-cyano-3,3-diphenylacrylate YANG HAIZHONG 2015-06-03 CN claimed
CN-101994485-B Thermoplastic oil delivery pipeline system HEBEI HONGGUANG RUBBER & PLASTIC METAL PRODUCTS CO LTD 2014-04-30 CN claimed
CN-102883705-A Personal care formulations containing alkyl ketal esters and methods of manufacture SEGETIS INC 2013-01-16 CN claimed
CN-101106971-B Cosmetic compositions containing sophora alopecuroides extracts UNILEVER NV 2012-11-14 CN claimed
CN-102731921-A Weatherproof polymer alloy used for replacing ABS CHENGDU SOLVER TECHNOLOGY CO LTD 2012-10-17 CN claimed
CN-102604318-A Short-fiber modified ABS/PET (Acrylonitrile Butadiene Styrene/Polyethylene Terephthalate) resin alloy material and preparation method thereof CHENGDU SOLVER TECHNOLOGY CO LTD 2012-07-25 CN claimed
CN-102448291-A Method for reducing sun damage of plants BASF SE 2012-05-09 CN claimed
CN-1902180-A Use of 4-cyano-naphthalene-1, 8-dicarboximide derivatives and related compounds for protecting organic materials from the damaging effects of light BASF AG (DE) 2007-01-24 CN claimed
CN-110337292-A Pharmaceuticals 兴和株式会社 2019-10-15 CN disclosed
CN-105911205-B The method that Liquid Chromatography/Mass Spectrometry detects 3 kinds of ultraviolet absorber Special migrations 中华人民共和国台州出入境检验检疫局 2017-10-10 CN disclosed
CN-107126660-A A kind of composition for including fluorinated ketones contained 中化蓝天集团有限公司 2017-09-05 CN disclosed
CN-104508516-B (meth) acrylate compound, optical composition, molded article, and optical element CANON KABUSHIKI KAISHA (JP) 2016-06-01 CN disclosed
CN-1175316-A Retroreflective sheet NIPPON CARBIDE KOGYO KK (JP) 1998-03-04 CN disclosed
US-5595872-A DNA SEQUENCES, CELLS AND EXPRESSION VECTORS BRISTOL-MYERS SQUIBB COMPANY (US) 1997-01-21 US disclosed
CN-1137285-A Novel fluoran compound, intermediate, and chromogenic recording material NIPPON SODA CO (JP) 1996-12-04 CN disclosed
CN-1130625-A 2-hydroxyphenyltriazines CIBA GEIGY AG (CH) 1996-09-11 CN disclosed
EP-0643057-A1 Inhibitors of microsomal triglyceride transfer protein BRISTOL-MYERS SQUIBB COMPANY (US) 1995-03-15 EP disclosed