SCHEMBL325087

SCHEMBL325087

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nearest known ligand 0.38

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 1/20 0.38
MAPK1 P28482 1/20 0.38
ALDH1A1 P00352 1/20 0.33

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
SCHEMBL15302 1.00
SCHEMBL10895362 1.00 TRPA1 (0.38) TRPA1MAPK1ALDH1A1
SCHEMBL28341893 1.00
SCHEMBL432583 1.00
SCHEMBL26134 1.00
SCHEMBL6696460 0.96 ALDH1A1 (0.39) TRPA1MAPK1ALDH1A1
Hydrochloric Acid SCHEMBL5798467 0.96
SCHEMBL9145167 0.96 TRPA1 (0.35) TRPA1MAPK1ALDH1A1
Methane SCHEMBL21357925 0.96
SCHEMBL21436120 0.96

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200140595-A1 Vulcanizable Compositions Comprising Hydrogenated Nitrile-Diene-Carboxylic Ester Copolymer and Silica ARLANXEO DEUTCHLAND GMBH (DE) 2020-05-07 US claimed
US-20090062451-A1 SYNTHESIS OF A LIQUID POLYMER AND A FUNCTIONALIZED POLYMER BRIDGESTONE CORPORATION (JP) 2009-03-05 US claimed
EP-0827423-B1 FUNCTIONALIZED CHAIN EXTENDED INITIATORS FOR ANIONIC POLYMERIZATION FMC CORP (US) 2007-12-12 EP claimed
US-20070149649-A1 Non-spherical nanoparticles made from living triblock polymer chains BRIDGESTONE CORPORATION (JP) 2007-06-28 US claimed
US-20020173607-A1 Protected aminofunctionalized polymerization initiators and methods of making and using same FMC CORPORATION 2002-11-21 US claimed
CN-115210272-B Methods and embodiments for producing modified polydienes 公共型股份公司希布尔控股 2024-06-28 CN disclosed
CN-116987219-A Process for continuous polymerization of conjugated diolefins 中国石油化工股份有限公司 2023-11-03 CN disclosed
CN-105793306-B For the functionalized resins of high-performance tire 埃克森美孚化学专利公司 2018-06-05 CN disclosed
US-9586338-B2 Methods for making lignocellulose containing composite products GEORGIA-PACIFIC CHEMICALS LLC (US) 2017-03-07 US disclosed
US-9447209-B2 Process for the preparation of diene polymers or of random vinyl arene-diene copolymers VERSALIS S.P.A. (IT) 2016-09-20 US disclosed
US-20150203611-A1 PROCESS FOR THE PREPARATION OF DIENE POLYMERS OR OF RANDOM VINYL ARENE-DIENE COPOLYMERS VERSALIS S.P.A. (IT) 2015-07-23 US disclosed
US-20150183991-A1 FLAME-RETARDANT THERMOPLASTIC RESIN COMPOSITION AND MOLDED ARTICLE OF THE SAME ASAHI KASEI CHEMICALS CORPORATION (JP) 2015-07-02 US disclosed
EP-0298578-A2 Polymeric viscosity index additive and oil composition comprising the same SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1989-01-11 EP disclosed
EP-0243571-A2 Initiator system for polymerization of 1,3-dienes or copolymers containing 1,3-dienes THE FIRESTONE TIRE & RUBBER COMPANY (US) 1987-11-04 EP disclosed
US-4647635-A Initiator systems for polymerization of 1,3-dienes or copolymers containing 1,3-dienes THE FIRESTONE TIRE & RUBBER COMPANY (US) 1987-03-03 US disclosed
US-4631314-A HOT MELT ADHESIVES, MOLDING MATERIALS, COATINGS THE DOW CHEMICAL COMPANY (US) 1986-12-23 US disclosed
US-4537916-A SHELL-CORE POLYMER THE DOW CHEMICAL COMPANY (US) 1985-08-27 US disclosed
US-4246183-A CATALYTIC DIMERIZATION AND CARBONYLATION TEXACO DEVELOPMENT CORP. (US) 1981-01-20 US disclosed
US-4172087-A COORDINATION CATALYSTS CONTAINING PALLADIUM TEXACO DEVELOPMENT CORPORATION (US) 1979-10-23 US disclosed
US-4124617-A CATALYST COMPRISING PALLADIUM SALTS COMBINED WITH TERTIARY PHOSPHORUS CONTAINING LIGANDS TEXACO DEVELOPMENT CORPORATION (US) 1978-11-07 US 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 (2 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-20090062451-A1 SYNTHESIS OF A LIQUID POLYMER AND A FUNCTIONALIZED POLYMER FGB, FIP1L1, PUF60 TRPA1 3645/4885MAPK1 2050/4885ALDH1A1 1640/4885
US-20020173607-A1 Protected aminofunctionalized polymerization initiators and methods of making and using same PAM, PNMT, AAAS TRPA1 3524/4885MAPK1 2749/4885ALDH1A1 1618/4885

“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.