SCHEMBL4457041

SCHEMBL4457041

C=C(C)C(N)=O.C=CC(=O)NC(C)(C)CS(=O)(=O)O

nearest known ligand 0.40

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
TDP1 Q9NUW8 1/20 0.36
TSHR P16473 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
SCHEMBL28820478 0.91 ALDH1A1 (0.44) ALDH1A1CYP3A4CYP2C9CYP2C19MEN1
Methacrylic Acid SCHEMBL1133794 0.89 ALDH1A1 (0.44) ALDH1A1CYP3A4CYP2C9CYP2C19MEN1
Acrylamide SCHEMBL861020 0.89 ALDH1A1 (0.43) ALDH1A1CYP3A4CYP2C9CYP2C19MEN1
Acetone SCHEMBL28537994 0.89 ALDH1A1 (0.45) ALDH1A1CYP3A4CYP2C9CYP2C19MEN1
Methylamine SCHEMBL9615124 0.89 ALDH1A1 (0.45) ALDH1A1CYP3A4CYP2C9CYP2C19MEN1
SCHEMBL19490 0.89 ALDH1A1 (0.47) ALDH1A1CYP3A4CYP2C9CYP2C19MEN1
SCHEMBL28723020 0.89 ALDH1A1 (0.47) ALDH1A1CYP3A4CYP2C9CYP2C19MEN1
SCHEMBL9773819 0.88 ALDH1A1 (0.40) ALDH1A1CYP3A4CYP2C9CYP2C19MEN1
Methacrylic Acid SCHEMBL30975120 0.88 ALDH1A1 (0.43) ALDH1A1CYP3A4CYP2C9CYP2C19MEN1
Methacrylic Acid SCHEMBL28266674 0.88 ALDH1A1 (0.43) ALDH1A1CYP3A4CYP2C9CYP2C19MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11035080-B2 Boronic acid containing polymers for papermaking process ECOLAB USA INC. (US) 2021-06-15 US claimed
EP-3390715-B1 BORONIC ACID CONTAINING POLYMERS FOR PAPERMAKING PROCESS ECOLAB USA INC (US) 2020-12-02 EP claimed
US-20180327972-A1 BORONIC ACID CONTAINING POLYMERS FOR PAPERMAKING PROCESS ECOLAB USA INC. (US) 2018-11-15 US claimed
EP-3390715-A1 BORONIC ACID CONTAINING POLYMERS FOR PAPERMAKING PROCESS Ecolab USA Inc. (US) 2018-10-24 EP claimed
WO-2017106310-A1 BORONIC ACID CONTAINING POLYMERS FOR PAPERMAKING PROCESS ECOLAB USA INC. (US) 2017-06-22 WO claimed
EP-1578817-B1 AQUEOUS POLYMER DISPERSIONS BASF AG (DE) 2006-09-06 EP claimed
US-20060122322-A1 Aqueous polymer dispersions BASF AKTIENGESELLSCHAFT (DE) 2006-06-08 US claimed
CN-109072565-B Softener compositions 凯米拉公司 2021-07-30 CN disclosed
US-11035080-B2 Boronic acid containing polymers for papermaking process ECOLAB USA INC. (US) 2021-06-15 US disclosed
EP-3390715-B1 BORONIC ACID CONTAINING POLYMERS FOR PAPERMAKING PROCESS ECOLAB USA INC (US) 2020-12-02 EP disclosed
US-20200149223-A1 SOFTENER COMPOSITION KEMIRA OYJ (FI) 2020-05-14 US disclosed
EP-3423632-B1 A SOFTENER COMPOSITION KEMIRA OYJ (FI) 2020-05-13 EP disclosed
CN-107912045-B Process for producing polyacrylamide composition 凯米拉公司 2020-05-05 CN disclosed
US-20010023753-A1 Method for flocculating a papermaking furnish using colloidal borosilicates ECOLAB USA INC. 2001-09-27 US disclosed
US-6270627-B1 IN CONJUNCTION WITH A HIGH MOLECULAR WEIGHT SYNTHETIC FLOCCULANT AND/OR STARCH, WITH OR WITHOUT THE ADDITON OF A CATIONIC COAGULANT; IMPROVED LEVELS OF RETENTION, FORMATION, UNIFORM POROSITY, AND OVERALL DEWATERING NALCO CHEMICAL COMPANY 2001-08-07 US disclosed
WO-2000075074-A1 STABLE SILICA SOLS OF HIGH SURFACE AREA AND IMPROVED ACTIVITY NALCO CHEMICAL COMPANY (US) 2000-12-14 WO disclosed
EP-1023241-A1 COLLOIDAL BOROSILICATES AND THEIR USE IN THE PRODUCTION OF PAPER NALCO CHEMICAL COMPANY (US) 2000-08-02 EP disclosed
WO-1999016708-A1 COLLOIDAL BOROSILICATES AND THEIR USE IN THE PRODUCTION OF PAPER NALCO CHEMICAL COMPANY (US) 1999-04-08 WO disclosed
EP-0289767-A2 Granulated absorbent Degussa Aktiengesellschaft (DE) 1988-11-09 EP disclosed
EP-0289768-A2 Phosphate-free detergent builder Degussa Aktiengesellschaft (DE) 1988-11-09 EP disclosed