SCHEMBL1780649

SCHEMBL1780649

CC(C)C(C(=O)Cl)c1ccc(Cl)cc1

nearest known ligand 0.65

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
FFAR2 O15552 18/20 0.65
MEN1 O00255 1/20 0.48
LMNA P02545 1/20 0.48
KMT2A Q03164 1/20 0.48
BRD4 O60885 1/20 0.47

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
SCHEMBL10614585 1.00 FFAR2 (0.65) FFAR2MEN1LMNAKMT2ABRD4
SCHEMBL3880453 1.00 FFAR2 (0.65) FFAR2MEN1LMNAKMT2ABRD4
SCHEMBL10916846 0.89 FFAR2 (0.52) FFAR2
SCHEMBL10606078 0.84 FFAR2 (0.61) FFAR2MEN1LMNAKMT2A
Potassium Ion SCHEMBL11095694 0.84 FFAR2 (0.61) FFAR2MEN1LMNAKMT2A
SCHEMBL10607297 0.84 FFAR2 (0.61) FFAR2MEN1LMNAKMT2A
SCHEMBL1405698 0.83 FFAR2 (0.65) FFAR2MEN1LMNAKMT2A
SCHEMBL68169 0.83 FFAR2 (0.65) FFAR2MEN1LMNAKMT2A
SCHEMBL10757938 0.83 FFAR2 (0.65) FFAR2MEN1LMNAKMT2ABRD4
SCHEMBL10918255 0.83 FFAR2 (0.46) FFAR2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116947627-A Acylation reaction method of 2- (4-chlorophenyl) -3-methylbutyryl chloride 安徽海顺化工有限公司 2023-10-27 CN claimed
CN-103554176-B One group of thiophosphoryl compound QINGDAO AGRICULTURAL UNIVERSITY (CN) 2016-04-27 CN claimed
CN-103554176-A Thiophosphoryl compounds UNIV QINGDAO AGRICULTURAL 2014-02-05 CN claimed
US-7560585-B2 Process for preparing (S)- alpha-cyano-3-phenoxybenzyl-(S)-2-(4-chlorophenyl)-isovalerate COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2009-07-14 US claimed
CN-100340543-C Cyfluthrin hapten compound, its synthesis method and use UNIV ZHEJIANG (CN) 2007-10-03 CN claimed
CN-1294417-C Fenvalerate direct competition enzyme joint immune absorption analysis technology and its kit UNIV YANGZHOU (CN) 2007-01-10 CN claimed
US-20060128982-A1 Process for preparing (S)- alpha-cyano-3-phenoxybenzyl-(S)-2-(4-chlorophenyl)-isovalerate COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH 2006-06-15 US claimed
WO-2006010994-A1 PROCESS FOR PREPARING (S)-ALPHA-CYANO-3-PHENOXYBENZYL-(S)-2-(4-CHLOROPHENYL)-ISOVALERATE COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2006-02-02 WO claimed
CN-1239473-C Fenvalerate preparing process UNIV NANKAI (CN) 2006-02-01 CN claimed
CN-1624480-A Fenvalerate direct competition enzyme joint immune absorption analysis technology and its kit UNIV YANGZHOU (CN) 2005-06-08 CN claimed
EP-0098942-B1 OPTICALLY ACTIVE IMIDAZOLYLPROPANOL COMPOUNDS, AND THEIR PRODUCTION AND USE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1986-03-12 EP claimed
EP-0172380-A2 Preparation of cyanomethyl esters E.I. DU PONT DE NEMOURS AND COMPANY (US) 1986-02-26 EP claimed
US-4570017-A Preparation of optically-active (mixed) anhydrides and acids SHELL OIL COMPANY (US) 1986-02-11 US claimed
US-4560515-A NON-SYMMETRICAL KETENE REACTED WITH A-HYDROXYNITRILE; TERTUARY AMINE CATALYST SHELL OIL COMPANY (US) 1985-12-24 US claimed
US-4546198-A Asymmetric synthesis of esters and acids SHELL OIL COMPANY (US) 1985-10-08 US claimed
US-4529810-A Preparation of optically-active alpha-substituted carboxylic esters and acids SHELL OIL COMPANY (US) 1985-07-16 US claimed
EP-0098942-A1 Optically active imidazolylpropanol compounds, and their production and use SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1984-01-25 EP claimed
US-4211727-A CADMIUM BOROHYDRIDE COMPLEX AS REDUCING AGENT SHELL OIL COMPANY (US) 1980-07-08 US claimed
EP-0003242-A1 Process for the preparation of alpha-cyanobenzyl esters SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1979-08-08 EP claimed
US-4153626-A Preparation of α-cyanobenzyl esters SHELL OIL COMPANY (US) 1979-05-08 US claimed

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-20060128982-A1 Process for preparing (S)- alpha-cyano-3-phenoxybenzyl-(S)-2-(4-chlorophenyl)-isovalerate PCCA, CHRNE, CHRNB4 FFAR2 2622/4885MEN1 3940/4885LMNA 862/4885

“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.