Acrylonitrile

Acrylonitrile

SCHEMBL277295

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

nearest known ligand 0.43

Full drug profile on Sugi Atlas →

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TSHR P16473 10/20 0.43
ALDH1A1 P00352 6/20 0.43
TP53 P04637 3/20 0.43
HIF1A Q16665 3/20 0.43
CYP3A4 P08684 3/20 0.43
HSD17B10 Q99714 2/20 0.43
MAPT P10636 1/20 0.43
CACNA1B Q00975 1/20 0.43
APBA1 Q02410 1/20 0.43
MAPK1 P28482 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
HPGD P15428 1/20 0.39
APP P05067 1/20 0.36
THRB P10828 2/20 0.33
PTP4A3 O75365 1/20 0.33
PTP4A1 Q93096 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
NPSR1 Q6W5P4 1/20 0.30

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 SCHEMBL2578918 0.96 TSHR (0.41) TSHRALDH1A1TP53HIF1ACYP3A4
Acrylic Acid SCHEMBL460728 0.94 MAPT (0.40) TSHRALDH1A1TP53HIF1ACYP3A4
Acrylic Acid SCHEMBL28076455 0.93 MAPT (0.39) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL27290907 0.91 TSHR (0.46) TSHRALDH1A1TP53HIF1ACYP3A4
Benzene SCHEMBL28208682 0.91 CYP3A4 (0.40) TSHRALDH1A1TP53HIF1ACYP3A4
Water SCHEMBL1079113 0.89
Methacrylic Acid SCHEMBL460588 0.88 TSHR (0.37) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL31267242 0.87 TSHR (0.54) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL5167665 0.87 TSHR (0.54) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL19273 0.87

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0431094-A4 ANTIMICROBIAL CARPET AND CARPET TILE 1992-10-21 EP claimed
US-5024840-A Mixture of phosphoric acid ester or salt and latex polymer INTERFACE, INC. (US) 1991-06-18 US claimed
EP-0431094-A1 ANTIMICROBIAL CARPET AND CARPET TILE. INTERFACE INC (US) 1991-06-12 EP claimed
WO-1990014107-A1 ANTIMICROBIAL CARPET AND CARPET TILE INTERFACE, INC. (US) 1990-11-29 WO claimed
JP-9003782-A None JP disclosed
US-12043719-B2 Flame retardant mixture CLARIANT INTERNATIONAL LTD (CH) 2024-07-23 US disclosed
CN-118063856-A Flame retardant mixtures 科莱恩国际有限公司 2024-05-24 CN disclosed
EP-4367122-A1 SUSTAINABLY PRODUCED DIALKYLPHOSPHINIC SALTS Clariant International Ltd (CH) 2024-05-15 EP disclosed
EP-3652245-B1 ADDITIVE MIXTURES FOR PLASTICS, LASER-MARKABLE POLYMER COMPOSITIONS CONTAINING SAME, AND USE THEREOF CLARIANT INT LTD (CH) 2024-04-24 EP disclosed
EP-4337709-A1 ALKOXYLATES OF METHYLOL-ORGANYL-PHOSPHINE OXIDES, PROCESS FOR MANUFACTURE THEREOF, FLAME-RETARDANT POLYMERS AND USE THEREOF Clariant International Ltd (CH) 2024-03-20 EP disclosed
CN-117545760-A Sustainable dialkylphosphinic salts 科莱恩国际有限公司 2024-02-09 CN disclosed
US-20240002680-A1 COMPOSITIONS COMPRISING AMMONIUM POLYPHOSPHATES CLARIANT INTERNATIONAL LTD (CH) 2024-01-04 US disclosed
US-4820756-A Thioether substituted phenols and their use as stabilizers CIBA-GEIGY CORPORATION (US) 1989-04-11 US disclosed
EP-0144081-B1 THERMOPLASTIC RESIN COMPOSITION HAVING EXCELLENT IMPACT RESISTANCE AND HEAT RESISTANCE MITSUBISHI RAYON CO., LTD. (JP) 1989-02-22 EP disclosed
EP-0281075-A2 Thermal transfer material CANON KABUSHIKI KAISHA (JP) 1988-09-07 EP disclosed
US-4711799-A Apparatus and method for making a counter top and product of same GOVE GENE G (US) 1987-12-08 US disclosed
US-4608291-A Method for making a counter top and product of same GOVE GENE G 1986-08-26 US disclosed
US-4556692-A BLEND OF GRAFT COPOLYMER, A-METHYLSTYRENE COPOLYMER, RESIN CONTAINING NO A-METHYLSTYPENE MITSUBISHI RAYON CO., LTD. (JP) 1985-12-03 US disclosed
EP-0144081-A1 Thermoplastic resin composition having excellent impact resistance and heat resistance MITSUBISHI RAYON CO., LTD. (JP) 1985-06-12 EP disclosed
US-4511695-A GRAFT POLYMERS, CROSSLINKED ACRYLATE COPOLYMERS BAYER AKTIENGESELLSCHAFT (DE) 1985-04-16 US disclosed