SCHEMBL1509789

SCHEMBL1509789

CC=CCC(=O)CC=CC

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.35
CYP2D6 P10635 1/20 0.35
ALOX15 P16050 1/20 0.35
GRIK1 P39086 2/20 0.32
GRIK2 Q13002 2/20 0.32
TDP1 Q9NUW8 1/20 0.32
SOAT1 P35610 1/20 0.31
TSHR P16473 1/20 0.30

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
SCHEMBL28606494 1.00 ALDH1A1 (0.35) ALDH1A1CYP2D6ALOX15GRIK1GRIK2
SCHEMBL9113394 1.00 ALDH1A1 (0.35) ALDH1A1CYP2D6ALOX15GRIK1GRIK2
SCHEMBL11974548 0.88 SOAT1 (0.33) ALDH1A1CYP2D6ALOX15GRIK1GRIK2
SCHEMBL8960074 0.87
SCHEMBL4393364 0.85
SCHEMBL4393360 0.85
SCHEMBL14142784 0.85
SCHEMBL8978205 0.85
SCHEMBL5742284 0.84 FNTA (0.38) ALDH1A1ALOX15SOAT1
SCHEMBL1088911 0.83

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109328402-A Quantum dot light emitting device 陶氏环球技术有限责任公司 2019-02-12 CN claimed
CN-108570036-A A kind of polymorph and preparation method thereof of BTK inhibitor 北京赛林泰医药技术有限公司 2018-09-25 CN claimed
EP-0667029-A1 THIXOTROPIC MAGNETORHEOLOGICAL MATERIALS LORD CORPORATION (US) 1995-08-16 EP claimed
EP-0667029-A4 THIXOTROPIC MAGNETORHEOLOGICAL MATERIALS. LORD CORP (US) 1995-06-13 EP claimed
WO-1994010693-A1 THIXOTROPIC MAGNETORHEOLOGICAL MATERIALS LORD CORPORATION (US) 1994-05-11 WO claimed
JP-5255516-A None JP disclosed
CN-108701765-A The method for being used to prepare organic charge transport film 陶氏环球技术有限责任公司 2018-10-23 CN disclosed
CN-108570036-A A kind of polymorph and preparation method thereof of BTK inhibitor 北京赛林泰医药技术有限公司 2018-09-25 CN disclosed
CN-108138151-A BIOSYNTHESIS OF PHENYLPROPANOID AND DIHYDROPHENYLPROPANOID DERIVATIVES 埃沃尔瓦公司 2018-06-08 CN disclosed
CN-107849591-A The biosynthesis of Phenylpropanoid Glycosides class and Phenylpropanoid Glycosides analog derivative 埃沃尔瓦公司 2018-03-27 CN disclosed
EP-1160329-B1 An enzyme reaction method and a method for enzymatically producing an optically active cyanohydrin NIPPON CATALYTIC CHEM IND (JP) 2011-04-06 EP disclosed
EP-2295592-A1 An enzyme reaction method and a method for enzymatically producing an optically active cyanohydrin Nippon Shokubai Co., Ltd. (JP) 2011-03-16 EP disclosed
CN-100400513-C Phenylalanine enamide derivatives containing cyclobutene groups for use as integrin inhibitors CELLTECH R&D LTD (GB) 2008-07-09 CN disclosed
CN-1582276-A Phenylalanine enamide derivatives CELLTECH R&D LTD (GB) 2005-02-16 CN disclosed
JP-H05255516-A PREPARATION OF CROSSLINKED POLYMER BP CHEM INTERNATL LTD 1993-10-05 JP disclosed
EP-0407555-A4 POLYBUTYLKETONES AND HYDROXYESTERS OF EPOXIDIZED POLYBUTENES 1991-07-24 EP disclosed
US-5015697-A Polybutylketones and hydroxyesters of epoxidized polybutenes AMOCO CORPORATION (US) 1991-05-14 US disclosed
EP-0407555-A1 POLYBUTYLKETONES AND HYDROXYESTERS OF EPOXIDIZED POLYBUTENES AMOCO CORPORATION (US) 1991-01-16 EP disclosed
WO-1990008785-A1 POLYBUTYLKETONES AND HYDROXYESTERS OF EPOXIDIZED POLYBUTENES AMOCO CORPORATION (US) 1990-08-09 WO disclosed
US-4237331-A SEPARATING ISOBUTYLENES FROM AN OLEFIN STREAM BY FORMING CARBONYL COMPOUNDS IN THE PRESENCE OF A CATALYST COMPRISING A PALLADIUM COMPONENT, A COPPER COMPONENT AND A BORIC ACID PHILLIPS PETROLEUM COMPANY (US) 1980-12-02 US disclosed