Acrylonitrile

Acrylonitrile

SCHEMBL276892

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

nearest known ligand 0.43

Full drug profile on Sugi Atlas →

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TSHR P16473 6/20 0.43
THRB P10828 1/20 0.37
ALDH1A1 P00352 4/20 0.35
PTP4A3 O75365 2/20 0.35
PTP4A1 Q93096 2/20 0.35
PTP4A2 Q12974 1/20 0.34
CYP3A4 P08684 1/20 0.33
TDP1 Q9NUW8 1/20 0.32
MAPT P10636 1/20 0.31
CACNA1B Q00975 1/20 0.31
APBA1 Q02410 1/20 0.31
PLK1 P53350 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 SCHEMBL10815857 0.96 TSHR (0.46) TSHRTHRBALDH1A1PTP4A3PTP4A1
Methacrylic Acid SCHEMBL28076367 0.90 TSHR (0.41) TSHRTHRBALDH1A1PTP4A3PTP4A1
Butadiene SCHEMBL4557890 0.89 TSHR (0.47) TSHRTHRBALDH1A1CYP3A4TDP1
Acrylic Acid SCHEMBL28076521 0.89 TSHR (0.40) TSHRTHRBALDH1A1PTP4A3PTP4A1
Water SCHEMBL7714809 0.87 TSHR (0.48) TSHRTHRBALDH1A1PTP4A3PTP4A1
Water SCHEMBL1080260 0.87 TSHR (0.48) TSHRTHRBALDH1A1PTP4A3PTP4A1
SCHEMBL22017 0.85
SCHEMBL1057516 0.85 TSHR (0.50) TSHRTHRBALDH1A1CYP3A4TDP1
SCHEMBL6269152 0.85
SCHEMBL8921614 0.85

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
EP-4291605-A1 COMPOSITIONS COMPRISING AMMONIUM POLYPHOSPHATES Clariant International Ltd (CH) 2023-12-20 EP disclosed
CN-117242111-A Hydroxymethyl-organo-phosphine oxide alkoxylates, process for their production, flame-retardant polymers and their use 科莱恩国际有限公司 2023-12-15 CN disclosed
CN-116829633-A Compositions comprising ammonium polyphosphate 科莱恩国际有限公司 2023-09-29 CN disclosed
US-5298541-A Molding materials HOECHST AKTIENGESELLSCHAFT (DE) 1994-03-29 US disclosed
US-5177056-A PLASTICS COMPOSITION CONTAINING SUPERCONDUCTORS CIBA-GEIGY CORPORATION (US) 1993-01-05 US disclosed
US-5177246-A Hydroxphenylcarboxylic acid esters as stabilizers CIBA-GEIGY CORPORATION (US) 1993-01-05 US disclosed
US-5169925-A Light stabilizers for polymers; photooxidation resistance; nondestructive; nondiffusing; heat resistance; molding materials HOECHST AKTIENGESELLSCHAFT (DE) 1992-12-08 US disclosed
US-5116534-A AQUEOUS EMULSIONS CONTAINING ANTIOXIDANTS CIBA-GEIGY CORPORATION (US) 1992-05-26 US disclosed
US-5059689-A Stabilizers against damage by light, oxygen, heat CIBA-GEIGY CORPORATION (US) 1991-10-22 US disclosed
US-4820756-A Thioether substituted phenols and their use as stabilizers CIBA-GEIGY CORPORATION (US) 1989-04-11 US disclosed
US-4798822-A PHOTOSTABILIZERS FOR POLYMERS CIBA-GEIGY CORPORATION (US) 1989-01-17 US disclosed
US-4609698-A LIGHT STABILIZERS FOR POLYMERS CIBA-GEIGY CORPORATION (US) 1986-09-02 US disclosed
EP-0029803-B1 ORGANIC POLYMERIC MATERIALS STABILIZED WITH CALCIUM STEAROYL LACTATE K.K. Musashino Kagaku Kenkyusho (JP) 1985-06-19 EP disclosed