Acrylonitrile

Acrylonitrile

SCHEMBL534109

C=C(C)C(=O)OCC1CO1.C=CC#N

nearest known ligand 0.76

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Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.76
CYP3A4 P08684 2/20 0.41
TP53 P04637 1/20 0.41
TSHR P16473 4/20 0.39
CYP2D6 P10635 1/20 0.34
CYP2C19 P33261 1/20 0.34
THRB P10828 1/20 0.33
MGLL Q99685 3/20 0.32

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
Acrylonitrile SCHEMBL28168016 0.97 ALDH1A1 (0.71) ALDH1A1CYP3A4TP53TSHRCYP2D6
Acrylic Acid SCHEMBL17923567 0.94 ALDH1A1 (0.68) ALDH1A1CYP3A4TP53TSHRCYP2D6
Acrylonitrile SCHEMBL460863 0.93 ALDH1A1 (0.66) ALDH1A1CYP3A4TP53TSHRCYP2D6
Acrylonitrile SCHEMBL459164 0.89 ALDH1A1 (0.59) ALDH1A1CYP3A4TP53TSHRCYP2D6
SCHEMBL9562682 0.88 ALDH1A1 (0.81) ALDH1A1CYP3A4TP53TSHRCYP2D6
Propene SCHEMBL195063 0.87 ALDH1A1 (0.86) ALDH1A1CYP3A4TP53TSHRCYP2D6
Butadiene SCHEMBL8642792 0.87 ALDH1A1 (0.86) ALDH1A1CYP3A4TP53TSHRCYP2D6
Ammonia Solution, Strong SCHEMBL28216543 0.87 ALDH1A1 (0.93) ALDH1A1CYP3A4TP53TSHRCYP2D6
SCHEMBL5098171 0.87 ALDH1A1 (1.00) ALDH1A1CYP3A4TP53TSHRCYP2D6
SCHEMBL15617 0.87 ALDH1A1 (1.00) ALDH1A1CYP3A4TP53TSHRCYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114316539-B Weather-resistant low-temperature-resistant PLA alloy material, and preparation method and application thereof 金发科技股份有限公司 2024-03-15 CN claimed
US-8889009-B2 Process for purifying low molecular weight hydridosilanes EVONIK DEGUSSA GMBH (DE) 2014-11-18 US claimed
EP-2342163-B1 METHOD FOR PURIFYING LOW MOLECULAR HYDRIDOSILANES EVONIK DEGUSSA GMBH (DE) 2012-09-05 EP claimed
US-8226829-B2 membrane separation carried out under a carbon monoxide partial vapor pressure of more than 200 kPa Evonik Oxenc GmbH (DE) 2012-07-24 US claimed
EP-1976619-B1 METHOD FOR THE ELIMINATION OF METAL COMPLEX CATALYSTS FROM TELOMERIZATION MIXTURES EVONIK OXENO GMBH (DE) 2012-02-08 EP claimed
US-20110268642-A1 PROCESS FOR PURIFYING LOW MOLECULAR WEIGHT HYDRIDOSILANES EVONIK DEGUSSA GMBH (DE) 2011-11-03 US claimed
US-20090032465-A1 METHOD FOR THE ELIMINATION OF METAL COMPLEX CATALYSTS FROM TELOMERIZATION MIXTURES EVONIK OXENO GMBH (DE) 2009-02-05 US claimed
EP-1931472-B1 METHOD FOR SEPARATING ORGANIC TRANSITION METAL COMPLEX CATALYSTS EVONIK OXENO GMBH (DE) 2009-01-07 EP claimed
US-20080251456-A1 Method for Separating Organic Transition Metal Complex Catalysts EVONIK OXENO GMBH (DE) 2008-10-16 US claimed
US-4495243-A Release agent and product SEKISUI KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1985-01-22 US claimed
EP-0024908-A1 Release agent and products comprising a coating thereof SEKISUI KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1981-03-11 EP claimed
CN-120005240-A Multilayer film, polyimide film and cover film package 杜邦电子公司 2025-05-16 CN disclosed
EP-3027298-B1 MEMBRANE CASCADE WITH FALLING SEPARATING TEMPERATURE EVONIK OXENO GMBH & CO KG (DE) 2024-05-15 EP disclosed
US-11806669-B2 Variable and self-regulating permeate recycling in organophilic nanofiltration EVONIK OPERATIONS GMBH (DE) 2023-11-07 US disclosed
EP-4019117-A1 IMPROVED VARIABLE AND SELF-REGULATING PERMEATE RECOVERY IN ORGANOPHILIC NANOFILTRATION Evonik Operations GmbH (DE) 2022-06-29 EP disclosed
US-20090032465-A1 METHOD FOR THE ELIMINATION OF METAL COMPLEX CATALYSTS FROM TELOMERIZATION MIXTURES EVONIK OXENO GMBH (DE) 2009-02-05 US disclosed
US-20080251456-A1 Method for Separating Organic Transition Metal Complex Catalysts EVONIK OXENO GMBH (DE) 2008-10-16 US disclosed
US-5258234-A SUBSTRATE COATED WITH AN INK LAYER CONTAINING A COLORING AGENT, A COPOLYMER OF ACRYLONITRILE OR METHACRYLONITRILE AND AN ACRYLIC ESTER, AND A LUBRICANT RICOH COMPANY LTD. (JP) 1993-11-02 US disclosed
US-5250361-A Containing copolymer of (meth)acrylonitrile and acrylated ester RICOH COMPANY LTD. (JP) 1993-10-05 US disclosed
US-5001194-A First phase of a copolymer having a pendant epoxide group; a second phase of a copolymer having a functionality capable of reacting with the epoxide dispersed with the first phase THE DOW CHEMICAL COMPANY (US) 1991-03-19 US disclosed