SCHEMBL6848082

SCHEMBL6848082

C=CCOC(=O)CC(CO)CO

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.43
TSHR P16473 3/20 0.43
MAPT P10636 1/20 0.39
CACNA1B Q00975 1/20 0.39
APBA1 Q02410 1/20 0.39
CYP3A4 P08684 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
SMN1; SMN2 Q16637 2/20 0.36
PKM P14618 1/20 0.36
ALDH1A1 P00352 2/20 0.34
GAA P10253 1/20 0.34
HSD17B10 Q99714 1/20 0.33
EPHX2 P34913 1/20 0.30
CASP1 P29466 1/20 0.30
PRKCA P17252 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
SCHEMBL28662748 0.83 TSHR (0.47) TDP1TSHRMAPTCACNA1BAPBA1
SCHEMBL1907257 0.82 TDP1 (0.42) TDP1TSHRMAPTCACNA1BAPBA1
SCHEMBL7575730 0.80 TDP1 (0.41) TDP1TSHRMAPTCACNA1BAPBA1
SCHEMBL7573185 0.80 TDP1 (0.41) TDP1TSHRMAPTCACNA1BAPBA1
SCHEMBL8650694 0.78 TDP1 (0.46) TDP1TSHRMAPTCACNA1BAPBA1
SCHEMBL6154152 0.78 TDP1 (0.46) TDP1TSHRMAPTCACNA1BAPBA1
SCHEMBL6844643 0.78
SCHEMBL27916263 0.78 TDP1 (0.41) TDP1TSHRMAPTCACNA1BAPBA1
SCHEMBL7196449 0.77 TDP1 (0.44) TDP1TSHRMAPTCACNA1BAPBA1
SCHEMBL15918858 0.77 TDP1 (0.44) TDP1TSHRMAPTCACNA1BAPBA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6770702-B1 MICROPARTICLE DISPERSED IN WATER WITH CROSSLINKED EXTERIOR IN PRESENCE OF POLYESTERPOLYOL, POLYURETHANE, OR POLYACRYLATE PPG INDUSTRIES LACKE GMBH (DE) 2004-08-03 US claimed
EP-1173491-B1 POLYMER PPG IND LACKE GMBH (DE) 2003-12-03 EP claimed
US-6538059-B1 Ethylenically unsaturated monomer(s) crosslinked in presence of polyesterdiol, and polyurethane; automobile finishes PPG INDUSTRIES LACKE GMBH (DE) 2003-03-25 US claimed
EP-1185568-B1 POLYMER PPG IND LACKE GMBH (DE) 2002-12-04 EP claimed
CN-1357015-A Polymer and method of making same PPG IND LACKE GMBH (DE) 2002-07-03 CN claimed
CN-1355817-A Polymer PPG IND LACHE GMBH (DE) 2002-06-26 CN claimed
US-6770702-B1 MICROPARTICLE DISPERSED IN WATER WITH CROSSLINKED EXTERIOR IN PRESENCE OF POLYESTERPOLYOL, POLYURETHANE, OR POLYACRYLATE PPG INDUSTRIES LACKE GMBH (DE) 2004-08-03 US disclosed
US-6538059-B1 Ethylenically unsaturated monomer(s) crosslinked in presence of polyesterdiol, and polyurethane; automobile finishes PPG INDUSTRIES LACKE GMBH (DE) 2003-03-25 US disclosed
CN-1357015-A Polymer and method of making same PPG IND LACKE GMBH (DE) 2002-07-03 CN disclosed
CN-1355817-A Polymer PPG IND LACHE GMBH (DE) 2002-06-26 CN disclosed