Acrylonitrile

Acrylonitrile

SCHEMBL4871689

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

nearest known ligand 0.76

Full drug profile on Sugi Atlas →

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TSHR P16473 8/20 0.76
ALDH1A1 P00352 5/20 0.52
TP53 P04637 3/20 0.52
HIF1A Q16665 3/20 0.52
CYP3A4 P08684 2/20 0.52
HSD17B10 Q99714 1/20 0.52
HPGD P15428 1/20 0.47
MAPK1 P28482 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
THRB P10828 2/20 0.40

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
Acrylic Acid SCHEMBL29223373 0.94 TSHR (0.68) TSHRALDH1A1TP53HIF1ACYP3A4
Cyanate SCHEMBL28171190 0.90 TSHR (0.79) TSHRALDH1A1TP53HIF1ACYP3A4
Water SCHEMBL3297890 0.89
Acrylonitrile SCHEMBL1887927 0.89 TSHR (0.59) TSHRALDH1A1TP53HIF1ACYP3A4
Acrylonitrile SCHEMBL26970011 0.88 TSHR (0.69) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL14875 0.87
SCHEMBL30363554 0.87 TSHR (1.00) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL21630258 0.87 TSHR (1.00) TSHRALDH1A1TP53HIF1ACYP3A4
Cyanide SCHEMBL28306757 0.85 TSHR (0.86) TSHRALDH1A1TP53HIF1ACYP3A4
Ethylene SCHEMBL8048018 0.85 TSHR (0.95) TSHRALDH1A1TP53HIF1ACYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118108905-A Electrode slurry additive, preparation method and application thereof 深圳市研一新材料有限责任公司 2024-05-31 CN claimed
CN-115974629-B Low-sensitivity high-strength HMX-based composite material, preparation method and application thereof 西安近代化学研究所 2024-05-28 CN claimed
CN-115974629-A Low-sensitivity high-strength HMX-based composite material, and preparation method and application thereof 西安近代化学研究所 2023-04-18 CN claimed
CN-118108905-A Electrode slurry additive, preparation method and application thereof 深圳市研一新材料有限责任公司 2024-05-31 CN disclosed
CN-115974629-B Low-sensitivity high-strength HMX-based composite material, preparation method and application thereof 西安近代化学研究所 2024-05-28 CN disclosed
CN-115974629-B Low-sensitivity high-strength HMX-based composite material, preparation method and application thereof 西安近代化学研究所 2024-05-28 CN disclosed
CN-115974629-A Low-sensitivity high-strength HMX-based composite material, and preparation method and application thereof 西安近代化学研究所 2023-04-18 CN disclosed
CN-115974629-A Low-sensitivity high-strength HMX-based composite material, and preparation method and application thereof 西安近代化学研究所 2023-04-18 CN disclosed
CN-101880460-B Conductive composition and process for producing the same SHIN-ETSU POLYMER CO., LTD. (JP) 2011-12-28 CN disclosed
CN-101113238-B Conductive composition, and process for producing the same SHINETSU POLYMER CO 2011-09-28 CN disclosed
CN-101880460-A Electrically conductive composition and preparation method thereof SHINETSU POLYMER CO 2010-11-10 CN disclosed
CN-100551966-C Conductive composition, conductive coating material, conductive resin, capacitor, photoelectric conversion element, and method for producing same SHINETSU POLYMER CO (JP) 2009-10-21 CN disclosed
US-7341663-B2 Spiral-wound liquid membrane module for separation of fluids and gases THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF AGRICULTURE (US) 2008-03-11 US disclosed
CN-101113222-A Conductive composition, photo-electric converting element, and process for producing the same SHINETSU POLYMER CO (JP) 2008-01-30 CN disclosed
CN-101113238-A Conductive composition, and process for producing the same SHINETSU POLYMER CO (JP) 2008-01-30 CN disclosed
CN-1806005-A Conductive composition, conductive coating material, conductive resin, capacitor, photoelectric conversion element, and method for producing same SHINETSU POLYMER CO (JP) 2006-07-19 CN disclosed
WO-2006066269-A2 SPIRAL-WOUND LIQUID MEMBRANE MODULES FOR SEPARATION OF FLUIDS AND GASES THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY OF AGRICULTURE (US) 2006-06-22 WO disclosed
US-20060131235-A1 Spiral-wound liquid membrane module for separation of fluids and gases THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY OF AGRICULTURE (US) 2006-06-22 US disclosed
EP-1372023-A2 Electro-optically concealable vehicle instrument panel and method of constructing the same Ergom Automotive S.p.a. (IT) 2003-12-17 EP disclosed