SCHEMBL4032382

SCHEMBL4032382

CCCc1ccccc1CC(=O)O

nearest known ligand 0.57

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
AKR1B1 P15121 2/20 0.57
TDP1 Q9NUW8 1/20 0.50
ALDH1A1 P00352 2/20 0.46
HPGD P15428 1/20 0.46
HSD17B10 Q99714 1/20 0.46
CYP19A1 P11511 1/20 0.45
PTGS2 P35354 2/20 0.45
BCAT2 O15382 1/20 0.44
PPARG P37231 1/20 0.44
PPARA Q07869 1/20 0.44
CXCL8 P10145 4/20 0.43
KDM4E B2RXH2 1/20 0.43
CYP1A2 P05177 1/20 0.43
MAPT P10636 1/20 0.43
PTGS1 P23219 1/20 0.42

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
SCHEMBL2461497 0.88 ALDH1A1 (0.56) AKR1B1TDP1ALDH1A1HPGDHSD17B10
SCHEMBL7341368 0.86 ALDH1A1 (0.58) AKR1B1ALDH1A1HPGDHSD17B10PPARG
SCHEMBL8080347 0.85 CYSLTR2 (0.56) ALDH1A1PPARGPPARA
SCHEMBL8086397 0.85 CYSLTR2 (0.56) ALDH1A1PPARGPPARA
SCHEMBL5509741 0.85 CYSLTR2 (0.56) ALDH1A1PPARGPPARA
SCHEMBL8086516 0.85 CYSLTR2 (0.56) ALDH1A1PPARGPPARA
SCHEMBL8072594 0.85 CYSLTR2 (0.56) ALDH1A1PPARGPPARA
SCHEMBL9559902 0.85 CYSLTR2 (0.56) ALDH1A1PPARGPPARA
SCHEMBL10533245 0.85 CYSLTR2 (0.56) ALDH1A1PPARGPPARA
SCHEMBL509855 0.85 AKR1B1 (0.64) AKR1B1TDP1CYP19A1PTGS2BCAT2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114315636-B Synthesis method of 1-propyl- [4- (4' -butylphenylazo) ] azobenzene 烟台丰鲁精细化工有限责任公司 2024-02-27 CN claimed
US-20230301300-A1 HERBICIDAL COMPOSITIONS SYNGENTA CROP PROTECTION AG (CH) 2023-09-28 US disclosed
EP-3625222-B1 PHENYL DERIVATIVES AS PGE2 RECEPTOR MODULATORS IDORSIA PHARMACEUTICALS LTD (CH) 2021-07-21 EP disclosed
WO-2017192679-A1 METHODS AND COMPOSITIONS OF BIOLOGICALLY ACTIVE AGENTS WAVE LIFE SCIENCES LTD. (SG) 2017-11-09 WO disclosed
WO-2017062862-A2 OLIGONUCLEOTIDE COMPOSITIONS AND METHODS THEREOF WAVE LIFE SCIENCES LTD. (SG) 2017-04-13 WO disclosed
EP-2020225-B1 Fragrance composition KAO CORP (JP) 2014-10-08 EP disclosed
WO-2012168458-A1 ZWITTERIONIC COMPOUNDS USEFUL AS CATALYSTS FOR ESTERIFICATION REACTIONS AND PROCESSES FOR THEIR PRODUCTION ECOSYNTH BVBA (BE) 2012-12-13 WO disclosed
CN-101481495-A Aromatic polycarbonate resin composition TEIJIN CHEMICALS LTD (JP) 2009-07-15 CN disclosed
CN-101463185-A Aromatic polycarbonate resin composition TEIJIN CHEMICALS LTD (JP) 2009-06-24 CN disclosed
EP-1379240-A4 COMPOUNDS AND METHODS SMITHKLINE BEECHAM CORP (US) 2009-04-08 EP disclosed
EP-1552814-B1 FRAGRANCE COMPOSITION KAO CORP (JP) 2008-12-10 EP disclosed
EP-1379240-A1 COMPOUNDS AND METHODS SmithKline Beecham Corporation (US) 2004-01-14 EP disclosed
WO-2002078696-A1 COMPOUNDS AND METHODS SMITHKLINE BEECHAM CORPORATION (US) 2002-10-10 WO disclosed
EP-0758013-B1 Liquid crystalline optical film, compensating film for liquid crystal display and liquid crystal display NIPPON OIL CO LTD (JP) 2000-10-11 EP disclosed
US-5855971-A Liquid crystalline optical film, compensating film for liquid crystal display comprising the liquid crystalline optical film, and liquid crystal display having the compensating film NIPPON OIL COMPANY, LIMITED (JP) 1999-01-05 US disclosed
EP-0758013-A1 Liquid crystalline optical film, compensating film for liquid crystal display and liquid crystal display NIPPON OIL COMPANY, LIMITED (JP) 1997-02-12 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 (1 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-20230301300-A1 HERBICIDAL COMPOSITIONS GMDS, DDT, AADAC AKR1B1 1426/4885TDP1 3074/4885ALDH1A1 431/4885

“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.