SCHEMBL6574709

SCHEMBL6574709

O=C(O)C(=CCO)C1CCCCC1

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CES2 O00748 1/20 0.41
CES1 P23141 1/20 0.41
HDAC8 Q9BY41 1/20 0.35
HDAC6 Q9UBN7 1/20 0.35
TSHR P16473 2/20 0.34
ALDH1A1 P00352 1/20 0.34
EPHX1 P07099 1/20 0.34
GRIK1 P39086 1/20 0.32
HPGD P15428 1/20 0.32
HSD11B1 P28845 3/20 0.31
TAAR1 Q96RJ0 1/20 0.31
HAO1 Q9UJM8 1/20 0.31
HSD11B2 P80365 1/20 0.31
SRD5A2 P31213 1/20 0.31
RECQL P46063 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
SCHEMBL1651118 0.82 CES2 (0.39) CES2CES1HDAC8HDAC6TSHR
SCHEMBL990465 0.79 CES2 (0.36) CES2CES1HDAC8HDAC6ALDH1A1
SCHEMBL800571 0.79 CES2 (0.36) CES2CES1HDAC8HDAC6ALDH1A1
SCHEMBL5463371 0.78 EPHX1 (0.37) CES2CES1HDAC8HDAC6EPHX1
SCHEMBL11928271 0.77 CES2 (0.35) CES2CES1HDAC8HDAC6TSHR
SCHEMBL692341 0.76 NAAA (0.42) GRIK1
SCHEMBL2467390 0.76 CES2 (0.46) CES2CES1HDAC8HDAC6TSHR
SCHEMBL5698396 0.76 CES2 (0.46) CES2CES1HDAC8HDAC6TSHR
SCHEMBL2007012 0.76 CES2 (0.46) CES2CES1HDAC8HDAC6TSHR
SCHEMBL6474121 0.76 CES2 (0.46) CES2CES1HDAC8HDAC6TSHR

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 15 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1117716-B1 OLIGOMERIC AND HIGH-MOLECULAR CONVERSION PRODUCTS OF ALLOPHANIC ACID ESTERS WITH NUCLEOPHILIC COMPOUNDS , AND THE USE THEREOF BASF COATINGS AG (DE) 2004-11-17 EP disclosed
EP-1119592-B1 POWDER CLEAR VARNISH AND AQUEOUS POWDER CLEAR VARNISH SLURRY BASF COATINGS AG (DE) 2004-11-17 EP disclosed
EP-1165702-B1 POWDER-SLURRY THAT CAN BE HARDENED BY ACTINIC RADIATION OR BY THERMAL MEANS, METHOD FOR PRODUCING SAID SLURRY AND USE OF THE SAME BASF COATINGS AG (DE) 2004-04-28 EP disclosed
EP-1109775-B1 HYPERBRANCHED COMPOUNDS WITH A TETRAFUNCTIONAL CENTRAL GROUP AND USE OF SAME BASF COATINGS AG (DE) 2003-04-23 EP disclosed
EP-1115504-B1 SCRATCH-RESISTANT SOL-GEL COATING FOR CLEAR POWDER-SLURRY LACQUER BASF COATINGS AG (DE) 2003-02-12 EP disclosed
EP-1165702-A1 POWDER-SLURRY THAT CAN BE HARDENED BY ACTINIC RADIATION OR BY THERMAL MEANS, METHOD FOR PRODUCING SAID SLURRY AND USE OF THE SAME BASF Coatings Aktiengesellschaft (DE) 2002-01-02 EP disclosed
EP-1119592-A1 POWDER CLEAR VARNISH AND AQUEOUS POWDER CLEAR VARNISH SLURRY BASF Coatings AG (DE) 2001-08-01 EP disclosed
EP-1117716-A1 OLIGOMERIC AND HIGH-MOLECULAR CONVERSION PRODUCTS OF ALLOPHANIC ACID ESTERS WITH NUCLEOPHILIC COMPOUNDS AND LOW-MOLECULAR, OLIGOMERIC AND HIGH-MOLECULAR COMPOUNDS WITH ALLOPHANATE SIDE AND/OR TERMINAL GROUPS, AND THE USE THEREOF BASF Coatings AG (DE) 2001-07-25 EP disclosed
EP-1115504-A1 SCRATCH-RESISTANT SOL-GEL COATING FOR CLEAR POWDER-SLURRY LACQUER BASF Coatings AG (DE) 2001-07-18 EP disclosed
EP-1109775-A1 HYPERBRANCHED COMPOUNDS WITH A TETRAFUNCTIONAL CENTRAL GROUP AND USE OF SAME BASF Coatings AG (DE) 2001-06-27 EP disclosed
WO-2000050519-A1 POWDER-SLURRY THAT CAN BE HARDENED BY ACTINIC RADIATION OR BY THERMAL MEANS, METHOD FOR PRODUCING SAID SLURRY AND USE OF THE SAME BASF COATINGS AG (DE) 2000-08-31 WO disclosed
WO-2000016912-A1 SCRATCH-RESISTANT SOL-GEL COATING FOR CLEAR POWDER-SLURRY LACQUER BASF COATINGS AG (DE) 2000-03-30 WO disclosed
WO-2000015725-A1 POWDER CLEAR VARNISH AND AQUEOUS POWDER CLEAR VARNISH SLURRY BASF COATINGS AG (DE) 2000-03-23 WO disclosed
WO-2000014049-A1 HYPERBRANCHED COMPOUNDS WITH A TETRAFUNCTIONAL CENTRAL GROUP AND USE OF SAME BASF COATINGS AG (DE) 2000-03-16 WO disclosed
WO-2000012578-A1 OLIGOMERIC AND HIGH-MOLECULAR CONVERSION PRODUCTS OF ALLOPHANIC ACID ESTERS WITH NUCLEOPHILIC COMPOUNDS AND LOW-MOLECULAR, OLIGOMERIC AND HIGH-MOLECULAR COMPOUNDS WITH ALLOPHANATE SIDE AND/OR TERMINAL GROUPS, AND THE USE THEREOF BASF COATINGS AG (DE) 2000-03-09 WO disclosed