SCHEMBL2580716

SCHEMBL2580716

CCC(O)(O)C1CCCCC1

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.37
CHRM2 P08172 1/20 0.35
CYP2D6 P10635 1/20 0.35
CHRM1 P11229 1/20 0.35
KCNH2 Q12809 1/20 0.35
SHBG P04278 1/20 0.33
MEN1 O00255 1/20 0.31
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31
ALOX12 P18054 1/20 0.31
KMT2A Q03164 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
RECQL P46063 1/20 0.31
CA1 P00915 1/20 0.30
CA2 P00918 1/20 0.30
CA4 P22748 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
SCHEMBL31141764 0.86
SCHEMBL28308697 0.80 CYP1A2 (0.39) CYP1A2CHRM2CYP2D6CHRM1KCNH2
SCHEMBL10234483 0.79 CYP1A2 (0.37) CYP1A2CHRM2CYP2D6CHRM1KCNH2
SCHEMBL21810986 0.79 CHRM2 (0.39) CYP1A2CHRM2CYP2D6CHRM1KCNH2
SCHEMBL10876420 0.77 CYP1A2 (0.36) CYP1A2CHRM2CYP2D6CHRM1KCNH2
SCHEMBL10876431 0.77 CYP1A2 (0.36) CYP1A2CHRM2CYP2D6CHRM1KCNH2
SCHEMBL28508058 0.77 CHRM2 (0.38) CYP1A2CHRM2CYP2D6CHRM1KCNH2
SCHEMBL14463009 0.76 CYP1A2 (0.33) CYP1A2CHRM2CYP2D6CHRM1KCNH2
SCHEMBL17490396 0.76 CHRM2 (0.36) CYP1A2CHRM2CYP2D6CHRM1KCNH2
SCHEMBL10881574 0.76 CYP2D6 (0.30) CHRM2CYP2D6CHRM1KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2014001052-A1 ANTIMICROBIAL COMPOSITION UNILEVER N.V. (NL) 2014-01-03 WO claimed
WO-2013092277-A1 ANTIMICROBIAL METHOD AND COMPOSITION UNILEVER N.V. (NL) 2013-06-27 WO claimed
CN-1084776-C Water-dilutable stone impact protection coating and supplementary coating, use thereof and method for the production thereof BOLLIG & KEMPER (DE) 2002-05-15 CN claimed
CN-1131961-A Water-dilutable stone impact protection coating and supplementary coating, use thereof and method for the production thereof BOLLIG & KEMPER (DE) 1996-09-25 CN claimed
US-10472525-B2 Use of dithiophosphinic acid and/or its salts for producing anti-corrosion coatings that are devoid of chrome BASF COATINGS GMBH (DE) 2019-11-12 US disclosed
EP-1957557-B1 RADIATION-CURABLE DISPERSIBLE POLYURETHANES AND POLYURETHANE DISPERSIONS BASF SE (DE) 2019-07-17 EP disclosed
EP-1856173-B1 RADIATION-CURABLE AQUEOUS POLYURETHANE DISPERSIONS BASF SE (DE) 2017-05-31 EP disclosed
EP-1851276-B1 A METHOD FOR APPLYING ANTI-CORROSION COATINGS THAT ARE DEVOID OF CHROME COMPRISING DITHIOPHOSPHINIC ACID AND/OR ITS SALTS BASF COATINGS GMBH (DE) 2017-01-25 EP disclosed
US-20160168390-A1 USE OF DITHIOPHOSPHINIC ACID AND/OR ITS SALTS FOR PRODUCING ANTI-CORROSION COATINGS THAT ARE DEVOID OF CHROME BASF AKTIENGESELLSCHAFT (DE) 2016-06-16 US disclosed
CN-105452331-A Carboxy-functional polyster and diester derivatives BASF COATINGS GMBH 2016-03-30 CN disclosed
CN-102471519-B Method to produce composite material HUNTSMAN ADV MAT SWITZERLAND 2014-05-14 CN disclosed
WO-2014001052-A1 ANTIMICROBIAL COMPOSITION UNILEVER N.V. (NL) 2014-01-03 WO disclosed
US-20030153673-A1 Curable aqueous polyurethane dispersions BASF AKTIENGESELLSCHAFT (DE) 2003-08-14 US disclosed
EP-1294788-A1 CURABLE AQUEOUS POLYURETHANE DISPERSIONS BASF AKTIENGESELLSCHAFT (DE) 2003-03-26 EP disclosed
CN-1357015-A Polymer and method of making same PPG IND LACKE GMBH (DE) 2002-07-03 CN disclosed
CN-1356972-A Low viscosity acrylate monomers, formulations containing the same and uses thereof LOKTET CORP (US) 2002-07-03 CN disclosed
CN-1355817-A Polymer PPG IND LACHE GMBH (DE) 2002-06-26 CN disclosed
CN-1084776-C Water-dilutable stone impact protection coating and supplementary coating, use thereof and method for the production thereof BOLLIG & KEMPER (DE) 2002-05-15 CN disclosed
WO-2002000754-A1 CURABLE AQUEOUS POLYURETHANE DISPERSIONS BASF AKTIENGESELLSCHAFT (DE) 2002-01-03 WO disclosed
CN-1131961-A Water-dilutable stone impact protection coating and supplementary coating, use thereof and method for the production thereof BOLLIG & KEMPER (DE) 1996-09-25 CN disclosed