SCHEMBL5844959

SCHEMBL5844959

C=CC(=O)c1ccc([C]=O)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH5A1 P51649 1/20 0.59
ABAT P80404 1/20 0.59
AKT1 P31749 1/20 0.56
THRB P10828 8/20 0.48
THRA P10827 6/20 0.47
ALDH1A1 P00352 6/20 0.46
KMT2A Q03164 4/20 0.46
MEN1 O00255 3/20 0.46
PKM P14618 3/20 0.46
TDP1 Q9NUW8 3/20 0.46
MAPT P10636 3/20 0.46
HPGD P15428 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
MAPK1 P28482 2/20 0.46
KDM4E B2RXH2 1/20 0.46
EGFR P00533 1/20 0.46
TP53 P04637 1/20 0.46
CYP3A4 P08684 1/20 0.46
ALOX15 P16050 1/20 0.46
ALOX12 P18054 1/20 0.46

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
SCHEMBL14192454 0.84 ALDH5A1 (0.61) ALDH5A1ABATAKT1THRBTHRA
SCHEMBL4256312 0.83 ALDH5A1 (0.80) ALDH5A1ABATAKT1THRBTHRA
SCHEMBL5105673 0.81 ALDH5A1 (0.57) ALDH5A1ABATAKT1THRBTHRA
SCHEMBL4315033 0.77 ALDH5A1 (0.70) ALDH5A1ABATAKT1THRBTHRA
SCHEMBL10772833 0.77 ALDH5A1 (0.70) ALDH5A1ABATAKT1THRBTHRA
SCHEMBL14118267 0.76 ALDH5A1 (0.52) ALDH5A1ABATAKT1THRBTHRA
SCHEMBL14192559 0.75 MEN1 (0.56) ALDH5A1ABATAKT1THRBTHRA
SCHEMBL6274310 0.75 ALDH5A1 (0.67) ALDH5A1ABATAKT1THRBTHRA
SCHEMBL5090352 0.75 AKT1 (0.70) ALDH5A1ABATAKT1THRBTHRA
SCHEMBL6308381 0.75 ALDH5A1 (0.67) ALDH5A1ABATAKT1THRBTHRA

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
US-7135589-B2 Monomers for composite resins with acrylates for unsaturated derivative blends with acids, esters for derivatives with low shrinkage BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2006-11-14 US claimed
EP-1373184-B1 ULTRA-LOW SHRINKAGE COMPOSITE RESINS BASED ON BLENDED NEMATIC LIQUID CRYSTAL MONOMERS UNIV TEXAS (US) 2005-12-07 EP claimed
EP-1373184-A4 ULTRA-LOW SHRINKAGE COMPOSITE RESINS BASED ON BLENDED NEMATIC LIQUID CRYSTAL MONOMERS UNIV TEXAS (US) 2005-02-02 EP claimed
US-20040206934-A1 Ultra-low shrinkage composite resins based on blended nematic liquid crystal secondary monomers BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM 2004-10-21 US claimed
EP-1373184-A2 ULTRA-LOW SHRINKAGE COMPOSITE RESINS BASED ON BLENDED NEMATIC LIQUID CRYSTAL MONOMERS THE UNIVERSITY OF TEXAS SYSTEM (US) 2004-01-02 EP claimed
US-20030125435-A1 Ultra-low shrinkage composite resins based on blended nematic liquid crystal monomers NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2003-07-03 US claimed
WO-2002070543-A2 ULTRA-LOW SHRINKAGE COMPOSITE RESINS BASED ON BLENDED NEMATIC LIQUID CRYSTAL MONOMERS UNIVERSITY OF TEXAS SYSTEM (US) 2002-09-12 WO claimed
US-7135589-B2 Monomers for composite resins with acrylates for unsaturated derivative blends with acids, esters for derivatives with low shrinkage BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2006-11-14 US disclosed
US-7094358-B2 Ultra-low shrinkage composite resins based on blended nematic liquid crystal monomers THE UNIVERSITY OF TEXAS SYSTEM (US) 2006-08-22 US disclosed
EP-1373184-B1 ULTRA-LOW SHRINKAGE COMPOSITE RESINS BASED ON BLENDED NEMATIC LIQUID CRYSTAL MONOMERS UNIV TEXAS (US) 2005-12-07 EP disclosed
EP-1373184-A4 ULTRA-LOW SHRINKAGE COMPOSITE RESINS BASED ON BLENDED NEMATIC LIQUID CRYSTAL MONOMERS UNIV TEXAS (US) 2005-02-02 EP disclosed
US-20040206934-A1 Ultra-low shrinkage composite resins based on blended nematic liquid crystal secondary monomers BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM 2004-10-21 US disclosed
EP-1373184-A2 ULTRA-LOW SHRINKAGE COMPOSITE RESINS BASED ON BLENDED NEMATIC LIQUID CRYSTAL MONOMERS THE UNIVERSITY OF TEXAS SYSTEM (US) 2004-01-02 EP disclosed
US-20030125435-A1 Ultra-low shrinkage composite resins based on blended nematic liquid crystal monomers NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2003-07-03 US disclosed
WO-2002070543-A2 ULTRA-LOW SHRINKAGE COMPOSITE RESINS BASED ON BLENDED NEMATIC LIQUID CRYSTAL MONOMERS UNIVERSITY OF TEXAS SYSTEM (US) 2002-09-12 WO disclosed