Acrylonitrile

Acrylonitrile

SCHEMBL35882

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

nearest known ligand 0.34

Full drug profile on Sugi Atlas →

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.34
TSHR P16473 1/20 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
SCHEMBL250949 0.89 ALDH1A1 (0.42) ALDH1A1
SCHEMBL21667491 0.89 ALDH1A1 (0.42) ALDH1A1
Acrylonitrile SCHEMBL8018394 0.82 HCAR2 (0.41) ALDH1A1TSHR
Acrylic Acid SCHEMBL17746693 0.81 LMNA (0.39) ALDH1A1
Butadiene SCHEMBL9312044 0.80 ALDH1A1 (0.35) ALDH1A1
Acrylonitrile SCHEMBL2578917 0.78 PTP4A3 (0.33)
Acrylonitrile SCHEMBL22418820 0.77 ALDH1A1 (0.38) ALDH1A1TSHR
SCHEMBL5972487 0.77 ALDH1A1 (0.39) ALDH1A1TSHR
SCHEMBL14780680 0.77 ALDH1A1 (0.39) ALDH1A1TSHR
Acrylonitrile SCHEMBL6443897 0.77 TSHR (0.42) ALDH1A1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130202531-A1 INDICATORS FOR DETECTING THE PRESENCE OF METABOLIC BYPRODUCTS FROM MICROORGANISMS INDICATOR SYSTEMS INTERNATIONAL, INC. 2013-08-08 US claimed
EP-2382080-A1 INDICATORS FOR DETECTING THE PRESENCE OF METABOLIC BYPRODUCTS FROM MICROORGANISMS Indicator Systems International, Inc. (US) 2011-11-02 EP claimed
US-20110042344-A1 POLYMERIC INDICATORS FOR DETECTING THE PRESENCE OF METABOLIC BYPRODUCTS FROM MICROORGANISMS INDICATOR SYSTEMS INTERNATIONAL, INC. 2011-02-24 US claimed
US-20100196636-A1 INDICATORS FOR DETECTING THE PRESENCE OF METABOLIC BYPRODUCTS FROM MICROORGANISMS INDICATOR SYSTEMS INTERNATIONAL, INC. 2010-08-05 US claimed
WO-2010085755-A1 INDICATORS FOR DETECTING THE PRESENCE OF METABOLIC BYPRODUCTS FROM MICROORGANISMS INDICATOR SYSTEMS INTERNATIONAL, INC. (US) 2010-07-29 WO claimed
US-7749531-B2 Apparatus and method for detecting bacterial growth beneath a wound dressing INDICATOR SYSTEMS INTERNATIONAL (US) 2010-07-06 US claimed
WO-2009061831-A1 POLYMERIC INDICATORS FOR DETECTING THE PRESENCE OF METABOLIC BYPRODUCTS FROM MICROORGANISMS INDICATOR SYSTEMS INTERNATIONAL, INC. (US) 2009-05-14 WO claimed
EP-1893147-A2 APPARATUS AND METHOD FOR DETECTING BACTERIAL GROWTH BENEATH A WOUND DRESSING Indicator Systems International, Inc. (US) 2008-03-05 EP claimed
US-20070003606-A1 Apparatus and method for detecting bacterial growth beneath a wound dressing OSRAM SYLVANIA INC. 2007-01-04 US claimed
WO-2006133430-A2 APPARATUS AND METHOD FOR DETECTING BACTERIAL GROWTH BENEATH A WOUND DRESSING INDICATOR SYSTEMS INTERNATIONAL, INC. (US) 2006-12-14 WO claimed
US-6149952-A Method for determining deleterious bacterial growth in packaged food utilizing hydrophilic polymers Stoltenberg, Herbert W. (US) 2000-11-21 US claimed
WO-1999059431-A1 METHOD FOR DETERMINING DELETERIOUS BACTERIAL GROWTH IN PACKAGED FOOD UTILIZING HYDROPHILIC POLYMERS THOMAS J. HORAN FAMILY TRUST (US) 1999-11-25 WO claimed
US-5240525-A Laminating a first polymer film having low permeability to moisture to a second high nitrile gas barrier polymer THE STANDARD OIL COMPANY (US) 1993-08-31 US claimed
US-5084352-A Polymer blend films for food packages THE STANDARD OIL COMPANY (US) 1992-01-28 US claimed
EP-0246751-B1 MEDIUM FOR ELECTROPHORESIS FUJI PHOTO FILM CO., LTD. (JP) 1991-07-24 EP claimed
EP-0429185-A2 Multilayered barrier structures for packaging applications and method for the preparation thereof THE STANDARD OIL COMPANY (US) 1991-05-29 EP claimed
US-4914138-A POLYOLEFINS FUNCTIONALIZED WITH CARBOXYLIC ACIDS, ESTERS, ANHYDRIDES AND IMIDES; LOW VAPOR PERMEABILITY, FOR PACKAGING THE STANDARD OIL COMPANY (US) 1990-04-03 US claimed
EP-0356206-A2 Blends of high nitrile polymers and polyolefins and method for the preparation thereof THE STANDARD OIL COMPANY (US) 1990-02-28 EP claimed
EP-3873394-A1 SYSTEM FOR ANALYSIS OF BODY FLUIDS AND WOUND-ASSOCIATED BIOMOLECULES Progenitec, Inc. (US) 2021-09-08 EP disclosed
US-4914138-A POLYOLEFINS FUNCTIONALIZED WITH CARBOXYLIC ACIDS, ESTERS, ANHYDRIDES AND IMIDES; LOW VAPOR PERMEABILITY, FOR PACKAGING THE STANDARD OIL COMPANY (US) 1990-04-03 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100196636-A1 INDICATORS FOR DETECTING THE PRESENCE OF METABOLIC BYPRODUCTS FROM MICROORGANISMS PGLS, MGAM, G6PD ALDH1A1 244/4885TSHR 4176/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.