SCHEMBL2915596

SCHEMBL2915596

C[CH]C(=O)c1ccc(Cl)cc1

nearest known ligand 0.57

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.57
MAPT P10636 1/20 0.57
HPGD P15428 1/20 0.57
ALOX12 P18054 1/20 0.57
CYP2C19 P33261 1/20 0.57
CES2 O00748 3/20 0.54
CES1 P23141 3/20 0.54
ALOX15 P16050 1/20 0.52
TSHR P16473 1/20 0.52
MAOB P27338 5/20 0.52
MAOA P21397 2/20 0.52
CA1 P00915 2/20 0.50
CA2 P00918 2/20 0.50
CYP1B1 Q16678 1/20 0.50
CXCL12 P48061 1/20 0.48
SRD5A2 P31213 1/20 0.46
GSK3B P49841 1/20 0.46
MAPK1 P28482 1/20 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
SCHEMBL13960902 0.82 MAPT (0.63) CYP1A2MAPTHPGDALOX12CYP2C19
SCHEMBL28629808 0.82 MAPT (0.63) CYP1A2MAPTHPGDALOX12CYP2C19
SCHEMBL6998661 0.80 MAPT (0.67) CYP1A2MAPTHPGDALOX12CYP2C19
SCHEMBL6998663 0.80 MAPT (0.67) CYP1A2MAPTHPGDALOX12CYP2C19
SCHEMBL1673734 0.78 MAPK1 (0.58) CYP1A2MAPTHPGDALOX12CYP2C19
SCHEMBL7701991 0.78 ALDH1A1 (0.70) MAPTHPGDALOX12CES2CES1
SCHEMBL3265780 0.77 MAPT (0.53) CYP1A2MAPTHPGDALOX12CYP2C19
SCHEMBL7678400 0.77 MAPT (0.58) CYP1A2MAPTHPGDALOX12CYP2C19
SCHEMBL7678407 0.77 MAPT (0.58) CYP1A2MAPTHPGDALOX12CYP2C19
SCHEMBL23659067 0.76 CES2 (0.54) CYP1A2MAPTHPGDALOX12CYP2C19

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 19 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106401868-B A kind of pedestal vertical axis angle variable wind generator system and its working method 徐州工程学院 2019-04-05 CN claimed
US-10383831-B2 2,4,6-trialkoxystryl aryl sulfones, sulfonamides and carboxamides, and methods of preparation and use Temple University—Of the Commonwealth System of Higher Education (US) 2019-08-20 US disclosed
CN-106401868-B A kind of pedestal vertical axis angle variable wind generator system and its working method 徐州工程学院 2019-04-05 CN disclosed
CN-106242968-B By α, method that β unsaturated carboxylic acids and ketone compounds directly synthesize the alpha-acyloxy ketone derivatives containing ethylenic unsaturation 沅江华龙催化科技有限公司 2018-11-06 CN disclosed
CN-106220496-B By α, method that β unsaturated carboxylic acids and phenylpropyl alcohol ketone class compound directly synthesize the alpha-acyloxy ketone derivatives containing ethylenic unsaturation 沅江华龙催化科技有限公司 2018-10-26 CN disclosed
CN-106220495-B The method that the alpha-acyloxy ketone derivatives containing ethylenic unsaturation are directly synthesized by α-reaction kinetic of ketone 沅江华龙催化科技有限公司 2018-10-26 CN disclosed
US-20180243239-A1 2,4,6-TRIALKOXYSTRYL ARYL SULFONES, SULFONAMIDES AND CARBOXAMIDES, AND METHODS OF PREPARATION AND USE TEMPLE UNIVERSITY - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION 2018-08-30 US disclosed
CN-106242968-A The method being directly synthesized α acyloxy ketone derivatives containing ethylenic unsaturation by α, β unsaturated carboxylic acid and ketone compounds 沅江华龙催化科技有限公司 2016-12-21 CN disclosed
CN-106220495-A The method being directly synthesized α acyloxy ketone derivatives containing ethylenic unsaturation by the α reaction kinetic of ketone 沅江华龙催化科技有限公司 2016-12-14 CN disclosed
CN-106220496-A The method being directly synthesized α acyloxy ketone derivatives containing ethylenic unsaturation by α, β unsaturated carboxylic acid and propiophenone compounds 沅江华龙催化科技有限公司 2016-12-14 CN disclosed
US-20110065715-A1 Nogo Receptor Binding Small Molecules to Promote Axonal Growth YALE UNIVERSITY (US) 2011-03-17 US disclosed
EP-2220499-A2 NOGO RECEPTOR BINDING SMALL MOLECULES TO PROMOTE AXONAL GROWTH Yale University (US) 2010-08-25 EP disclosed
WO-2009073141-A2 NOGO RECEPTOR BINDING SMALL MOLECULES TO PROMOTE AXONAL GROWTH STRITTMATTER STEPHEN M (US) 2009-06-11 WO disclosed
EP-0508549-B1 New triazolopyrimidine and pyrazolopyrimidine derivatives useful for treating cachexia SANKYO CO (JP) 1995-04-26 EP disclosed
US-5358949-A Carbostyril derivatives and salts thereof and anti-arrhythmic agents containing the carbostyril derivatives OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1994-10-25 US disclosed
EP-0347252-B1 METHOD OF TREATING CACHEXIA AND CERTAIN NEW COMPOUNDS FOR USE IN THIS METHOD SANKYO COMPANY LIMITED (JP) 1993-05-05 EP disclosed
EP-0508549-A2 New triazolopyrimidine and pyrazolopyrimidine derivatives useful for treating cachexia SANKYO COMPANY LIMITED (JP) 1992-10-14 EP disclosed
US-5086057-A METHOD OF TREATING CACHEXIA AND CERTAIN NEW COMPOUNDS FOR USE IN THIS METHOD SANKYO COMPANY LIMITED (JP) 1992-02-04 US disclosed
EP-0236140-A2 Carbostyril derivatives and salts thereof and anti-arrhythmic agents containing the carbostyril derivatives OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1987-09-09 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-10383831-B2 2,4,6-trialkoxystryl aryl sulfones, sulfonamides and carboxamides, and methods of preparation and use CCNY, STS, ARSA CYP1A2 606/4885MAPT 4501/4885HPGD 3416/4885
US-20110065715-A1 Nogo Receptor Binding Small Molecules to Promote Axonal Growth NGFR, GAP43, BDNF CYP1A2 3387/4885MAPT 333/4885HPGD 3233/4885
US-20180243239-A1 2,4,6-TRIALKOXYSTRYL ARYL SULFONES, SULFONAMIDES AND CARBOXAMIDES, AND METHODS OF PREPARATION AND USE CCNY, STS, ARSA CYP1A2 606/4885MAPT 4501/4885HPGD 3416/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.