Acrylonitrile

Acrylonitrile

SCHEMBL220918

C=CC#N.C=Cc1ccccc1C=C

nearest known ligand 0.48

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Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.48
TSHR P16473 4/20 0.47
TRPA1 O75762 1/20 0.34
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
LMNA P02545 1/20 0.33
THRB P10828 1/20 0.33
BLM P54132 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
CYP1A1 P04798 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP1B1 Q16678 1/20 0.31
KDM4E B2RXH2 1/20 0.31
GAA P10253 1/20 0.31
MAPT P10636 1/20 0.31
CACNA1B Q00975 1/20 0.31
APBA1 Q02410 1/20 0.31

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 SCHEMBL10952390 0.95 ALDH1A1 (0.44) ALDH1A1TSHRTRPA1MEN1KMT2A
1,1-Dichloroethene SCHEMBL27511898 0.89 ALDH1A1 (0.45) ALDH1A1TSHRTRPA1MEN1KMT2A
Water SCHEMBL9406244 0.86 ALDH1A1 (0.60) ALDH1A1TSHRTRPA1MEN1KMT2A
Water SCHEMBL20379011 0.86 ALDH1A1 (0.60) ALDH1A1TSHRTRPA1MEN1KMT2A
Acrylonitrile SCHEMBL28141132 0.85 SIRT2 (0.42) ALDH1A1TSHRMEN1KMT2AMAPT
Acrylonitrile SCHEMBL28064833 0.84 ALDH1A1 (0.40) ALDH1A1TSHRTRPA1LMNACYP1A2
Acrylonitrile SCHEMBL28107388 0.84 ALDH1A1 (0.75) ALDH1A1TSHRTRPA1LMNAKDM4E
Acrylonitrile SCHEMBL8511291 0.84 ALDH1A1 (0.45) ALDH1A1TSHRMEN1KMT2ABLM
Acrylonitrile SCHEMBL27562735 0.83 ALDH1A1 (0.41) ALDH1A1TSHR
Ammonia Solution, Strong SCHEMBL5087825 0.83 ALDH1A1 (0.57) ALDH1A1TSHRTRPA1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111032114-A Composite adsorbent, apparatus and method 沙特基础工业全球技术有限公司 2020-04-17 CN claimed
CN-110944746-A Composite adsorbent, apparatus and method 沙特基础工业全球技术有限公司 2020-03-31 CN claimed
CN-105377407-B polymer electrolyte membrane 明尼苏达大学评议会 2019-08-13 CN claimed
CN-105377407-A Polymer electrolyte membrane UNIV MINNESOTA 2016-03-02 CN claimed
CN-103382531-B A kind of method of producing enrichment gallium alumina technology mother liquor from aluminous fly-ash INSTITUTE OF PROCESS ENGINEERING, CHINESE ACADEMY OF SCIENCES (CN) 2015-09-30 CN claimed
US-11896953-B2 HLB copolymers SIGMA-ALDRICH CO. LLC (US) 2024-02-13 US disclosed
US-11896953-B2 HLB copolymers SIGMA-ALDRICH CO. LLC (US) 2024-02-13 US disclosed
CN-114728799-B Method for removing impurities from chlorosilane mixtures 瓦克化学股份公司 2023-11-28 CN disclosed
CN-111295242-B Improved HLB copolymers 西格马-奥尔德里奇有限责任公司 2023-06-13 CN disclosed
CN-111295242-B Improved HLB copolymers 西格马-奥尔德里奇有限责任公司 2023-06-13 CN disclosed
CN-115785333-A Production method of monodisperse chelate resin 安徽省丰华树脂有限公司 2023-03-14 CN disclosed
CN-114728799-A Process for removing impurities from chlorosilane mixtures 瓦克化学股份公司 2022-07-08 CN disclosed
US-4902413-A Organic-based porous microspheres for HPLC E. I. DU PONT DE NEMOURS & CO. (US) 1990-02-20 US disclosed
EP-0344755-A1 Components and catalysts for the polymerization of olefins MONTELL NORTH AMERICA INC. (US) 1989-12-06 EP disclosed
EP-0341556-A1 Organic-based porous microspheres for HPLC E.I. DU PONT DE NEMOURS AND COMPANY (US) 1989-11-15 EP disclosed
CN-88101397-A Process for producing olefin polymer and catalyst used therefor 1988-09-28 CN disclosed
US-4421865-A ISOTOPE EXCHANGING STANDARD OIL COMPANY (SOHIO) (US) 1983-12-20 US disclosed
EP-0067990-A1 PROCESS FOR THE PRODUCTION OF ALKALI METAL POLY ESTER SILICATE RESINOUS PRODUCTS BLOUNT, David H. (US) 1983-01-05 EP disclosed
WO-1982002388-A1 PROCESS FOR THE PRODUCTION OF ALKALI METAL POLYESTER SILICATE RESINOUS PRODUCTS BLOUNT DAVID H 1982-07-22 WO disclosed
US-4024092-A Polymer compositions containing stilbene halide additives FOSTER GRANT CO., INC. (US) 1977-05-17 US disclosed