SCHEMBL782365

SCHEMBL782365

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

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.39
CYP3A4 P08684 2/20 0.37
TDP1 Q9NUW8 1/20 0.36
SMN1; SMN2 Q16637 3/20 0.35
ALDH1A1 P00352 2/20 0.35
TP53 P04637 1/20 0.35
MAPK1 P28482 1/20 0.35
HIF1A Q16665 1/20 0.35
MAPT P10636 2/20 0.35
CACNA1B Q00975 1/20 0.35
APBA1 Q02410 1/20 0.35
HSD17B10 Q99714 1/20 0.33
PRKCA P17252 1/20 0.32
RHOA P61586 1/20 0.31
NPC1 O15118 1/20 0.30
POLB P06746 1/20 0.30
RAB9A P51151 1/20 0.30
NPSR1 Q6W5P4 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
SCHEMBL10033540 0.90 TSHR (0.40) TSHRCYP3A4TDP1SMN1; SMN2ALDH1A1
SCHEMBL9056217 0.87 TDP1 (0.35) TSHRCYP3A4TDP1SMN1; SMN2ALDH1A1
SCHEMBL17678816 0.86 CYP3A4 (0.33) TSHRCYP3A4TDP1SMN1; SMN2ALDH1A1
SCHEMBL12284015 0.83 TSHR (0.37) TSHRCYP3A4TDP1SMN1; SMN2ALDH1A1
SCHEMBL1361080 0.83 CYP3A4 (0.41) TSHRCYP3A4TDP1SMN1; SMN2ALDH1A1
SCHEMBL11012846 0.83 TSHR (0.43) TSHRCYP3A4TDP1SMN1; SMN2ALDH1A1
SCHEMBL8678916 0.83 TSHR (0.39) TSHRCYP3A4TDP1SMN1; SMN2ALDH1A1
SCHEMBL17982754 0.83 TK1 (0.36) PRKCA
SCHEMBL17982755 0.83 TK1 (0.36) PRKCA
SCHEMBL12752001 0.82 TSHR (0.40) TSHRCYP3A4TDP1SMN1; SMN2ALDH1A1

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 71 patents — showing the first 20. 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
EP-0674672-B2 AQUEOUS POLYMER DISPERSIONS FOR TRANSPARENT LACQUERS BOLLIG & KEMPER (DE) 2003-11-26 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
JP-2002542351-A 2002-12-10 JP 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
EP-1185568-A2 POLYMER PPG Industries Lacke GmbH (DE) 2002-03-13 EP claimed
EP-1173491-A2 POLYMER PPG Industries Lacke GmbH (DE) 2002-01-23 EP claimed
EP-1011984-A1 THERMAL WATERLESS LITHOGRAPHIC PRINTING PLATE Kodak Polychrome Graphics LLC (US) 2000-06-28 EP claimed
US-5919600-A COMPOSITE LAYER ON A SUBSTRATE COMPRISING: A LAYER OF PHOTOTHERMAL CONVERSION MATERIAL AND A THERMOPLASTIC POLYURETHANE CONTAINING ALLYL GROUPS AND A LAYER COMPRISING A CROSSLINKED SILICONE POLYMER; IMAGE BY INFRARED LASER CURING KODAK POLYCHROME GRAPHICS, LLC (US) 1999-07-06 US claimed
WO-1999011467-A1 THERMAL WATERLESS LITHOGRAPHIC PRINTING PLATE KODAK POLYCHROME GRAPHICS L.L.C. (US) 1999-03-11 WO claimed
EP-0797640-B1 AQUEOUS COATING AGENTS BOLLIG & KEMPER GMBH & CO KG (DE) 1998-11-11 EP claimed
EP-0797640-A1 AQUEOUS COATING AGENTS BOLLIG & KEMPER KG (DE) 1997-10-01 EP claimed
EP-0674672-B1 AQUEOUS POLYMER DISPERSIONS FOR TRANSPARENT LACQUERS BOLLIG & KEMPER (DE) 1997-07-16 EP claimed
WO-1996013558-A1 UNSATURATED BINDER COMPOSITION PERSTORP AB (SE) 1996-05-09 WO claimed
WO-1995033011-A1 AQUEOUS COATING AGENTS BOLLIG & KEMPER KG (DE) 1995-12-07 WO claimed
EP-0674672-A1 AQUEOUS POLYMER DISPERSIONS FOR TRANSPARENT LACQUERS. BOLLIG & KEMPER (DE) 1995-10-04 EP claimed
WO-1994013720-A1 AQUEOUS POLYMER DISPERSIONS FOR TRANSPARENT LACQUERS BOLLIG & KEMPER KG (DE) 1994-06-23 WO claimed