Acetonitrile

Acetonitrile

SCHEMBL304666

CC#N.CN1CCOCC1

nearest known ligand 0.36

Full drug profile on Sugi Atlas →

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.36
CA7 P43166 1/20 0.36
CA14 Q9ULX7 1/20 0.36
ALDH1A1 P00352 3/20 0.33
MGLL Q99685 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
SMN1; SMN2 Q16637 3/20 0.32
GAA P10253 2/20 0.32
HTT P42858 2/20 0.32
CTSS P25774 1/20 0.31
TSHR P16473 2/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
KEAP1 Q14145 1/20 0.31
KDM4E B2RXH2 1/20 0.31
MAPT P10636 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
Water SCHEMBL1760853 0.88
Water SCHEMBL3979759 0.88 CA12 (0.43) CA12CA7CA14ALDH1A1MGLL
Sulfuric Acid SCHEMBL7120564 0.87 CA12 (0.43) CA12CA7CA14ALDH1A1SMN1; SMN2
Sulfuric Acid SCHEMBL2374802 0.87 CA12 (0.43) CA12CA7CA14ALDH1A1SMN1; SMN2
SCHEMBL5471777 0.86 CA12 (0.35) CA12CA7CA14ALDH1A1MGLL
Hydrochloric Acid SCHEMBL6025830 0.85
Ammonia Solution, Strong SCHEMBL28389103 0.85 CA12 (0.41) CA12CA7CA14ALDH1A1MGLL
SCHEMBL4622 0.85
SCHEMBL1221354 0.85
SCHEMBL20614479 0.85 CA12 (0.45) CA12CA7CA14ALDH1A1MGLL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3642318-B1 BLEACHING USING PEROXYFORMIC ACID AND AN OXYGEN CATALYST ECOLAB USA INC (US) 2023-12-06 EP claimed
CN-110678537-B Bleaching using peroxyformic acid and oxygen catalysts 埃科莱布美国股份有限公司 2021-08-10 CN claimed
CN-110678537-A Bleaching using peroxyformic acid and oxygen catalysts 埃科莱布美国股份有限公司 2020-01-10 CN claimed
EP-3190168-B1 COATED BLEACH CATALYST DALLI WERKE GMBH & CO KG (DE) 2019-04-10 EP claimed
US-20190010428-A1 COATED BLEACH CATALYST(S) DALLI WERKE GMBH & CO KG (DE) 2019-01-10 US claimed
CN-108473919-A Coated bleaching catalyst 德利威克有限两合公司 2018-08-31 CN claimed
EP-3190168-A1 COATED BLEACH CATALYST Dalli-Werke GmbH & Co. KG. (DE) 2017-07-12 EP claimed
EP-2059582-A2 HIGH-CONCENTRATION ENZYME GRANULES AND DETERGENTS OR CLEANERS COMPRISING SUCH HIGH-CONCENTRATION ENZYME GRANULES Henkel AG & Co. KGaA (DE) 2009-05-20 EP claimed
WO-2008028896-A2 HIGH-CONCENTRATION ENZYME GRANULES AND DETERGENTS OR CLEANERS COMPRISING SUCH HIGH-CONCENTRATION ENZYME GRANULES HENKEL AG & CO. KGAA (DE) 2008-03-13 WO claimed
CN-1157369-C Method of preparing granular N-alkyl-ammonium acetonitrile salts BASF 2004-07-14 CN claimed
EP-1288283-A1 Antimicrobial compositions UNILEVER PLC (GB) 2003-03-05 EP claimed
EP-0892846-B1 BLEACHING POWER ENHANCERS FOR BLEACHES AND TEXTILE WASHING COMPOSITIONS BASF AG (DE) 2002-10-23 EP claimed
CN-1084331-C N-alkyl ammonium acetonitrile salts, methods therefor and compositions therewith CLOROX CO (US) 2002-05-08 CN claimed
CN-1345305-A Method of preparing granular N-alkyl-ammonium acetonitrile salts BASF AG (DE) 2002-04-17 CN claimed
CN-1076018-C N-alkyl ammonium acetonitrile bleach activators CLOROX CO (US) 2001-12-12 CN claimed
EP-0941299-B1 TEXTILE DETERGENT FORMULATION ON THE BASIS OF QUATERNIZED GLYCINE NITRILES, BLEACHING AGENTS, NONIONIC AND/OR ANIONIC TENSIDES AND CALCIUM ION AND/OR MAGNESIUM ION SEQUESTERING COMPOUNDS BASF AG (DE) 2001-08-29 EP claimed
US-6174853-B1 LAUNDERING BASF AKTIENGESELLSCHAFT (DE) 2001-01-16 US claimed
CN-1248970-A N-alkyl ammonium acetonitrile salts, methods therefor and compositions therewith CLOROX CO (US) 2000-03-29 CN claimed
US-5741437-A SOURCE OF ACTIVE OXYGEN REACTS WITH NITRILE FOR BLEACHING APPLICATIONS THE CLOROX COMPANY (US) 1998-04-21 US claimed
CN-1158125-A N-alkyl ammonium acetonitrile bleach activators CLOROX CO (US) 1997-08-27 CN claimed