SCHEMBL170796

SCHEMBL170796

C=CCC(=CN)C(N)=O

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL27272116 0.84
SCHEMBL27513945 0.83 ALDH1A1 (0.33)
SCHEMBL7856487 0.80
SCHEMBL7660541 0.80
SCHEMBL45772 0.80
SCHEMBL3889301 0.80
SCHEMBL9281800 0.78 ALDH1A1 (0.39)
SCHEMBL4557964 0.78 ALDH1A1 (0.39)
SCHEMBL4557967 0.78 ALDH1A1 (0.39)
SCHEMBL49388 0.76 ALDH1A1 (0.32)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108424494-A A kind of preparation method of the amphoteric resin of acetaldehyde and its application in papermaking 苏州派凯姆新能源科技股份有限公司 2018-08-21 CN claimed
US-20130129657-A1 SPRAYABLE COMPOSITION COMPRISING HIGH MOLECULAR WEIGHT CHARGED POLYMER ISP INVESTMENTS INC. (US) 2013-05-23 US claimed
EP-2555741-A1 SPRAYABLE COMPOSITION COMPRISING HIGH MOLECULAR WEIGHT CHARGED POLYMER ISP Investments Inc. (US) 2013-02-13 EP claimed
CN-101258232-B Delivery system for releasing silicone ingredients DOW CORNING 2013-02-06 CN claimed
US-20120149265-A1 PARTICULATE COMPOSITION BASF SE (DE) 2012-06-14 US claimed
CN-102482619-A Cationic polymer thickeners SPCM SA 2012-05-30 CN claimed
EP-2449050-A1 PARTICULATE COMPOSITION BASF SE (DE) 2012-05-09 EP claimed
WO-2011126978-A1 SPRAYABLE COMPOSITION COMPRISING HIGH MOLECULAR WEIGHT CHARGED POLYMER ISP INVESTMENTS INC. (US) 2011-10-13 WO claimed
CN-102190760-A Silicon-organic graft copolymers containing nitrogen EVONIK GOLDSCHMIDT GMBH 2011-09-21 CN claimed
WO-2011000688-A1 PARTICULATE COMPOSITION BASF SE (DE) 2011-01-06 WO claimed
US-5358566-A Comprising polymer salt from polycarboxylic acid and nitrogenous acrylic polymer; preventing slump loss SANDOZ LTD. (CH) 1994-10-25 US claimed
US-5321110-A Thickeners for shampoo, hair conditioners ISP INVESTMENTS INC. (US) 1994-06-14 US claimed
WO-1993025595-A1 CATIONIC POLYMER COMPOSITIONS ISP INVESTMENTS INC. (US) 1993-12-23 WO claimed
WO-1993022380-A1 POLYMERS OF VINYL-PYRROLIDONE AND AMINOALKYL ACRYLAMIDES ISP INVESTMENTS INC. (US) 1993-11-11 WO claimed
US-5219950-A Copolymerizing vinylpyrrolidone with an unsaturated amine, alcohol or N-aminoalkyl(meth)acrylamide; condensing with a haloacetal; acidolysis followed by iminization ISP INVESTMENTS INC. (US) 1993-06-15 US claimed
US-5209922-A Undecylenic acid salt of quaternized copolymer of vinylpyrrolidone and aminoalkylacrylamide ISP INVESTMENTS INC. (US) 1993-05-11 US claimed
US-5045617-A Zwitterion terpolymers of a vinyl lactam, an amino alkyl acrylamide or acrylate, and a polymerizable carboxylic acid ISP INVESTMENTS INC. (US) 1991-09-03 US claimed
CN-1031381-A Electrically conductive plastic moldings and preparation method thereof SUMITOMO CHEMICAL CO (JP) 1989-03-01 CN claimed
EP-0077618-B1 ADHESIVES FOR PREPASTED WALLCOVERINGS Ciba Specialty Chemicals Water Treatments Limited (GB) 1986-12-17 EP claimed
EP-0077618-A1 Adhesives for prepasted wallcoverings Ciba Specialty Chemicals Water Treatments Limited (GB) 1983-04-27 EP claimed