SCHEMBL7986937

SCHEMBL7986937

C=CC(=O)OOCC.CCC(CO)(CO)CO

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.47
TP53 P04637 3/20 0.47
HIF1A Q16665 3/20 0.47
CYP3A4 P08684 2/20 0.47
MAPK1 P28482 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
THRB P10828 2/20 0.44
TSHR P16473 8/20 0.35
HPGD P15428 1/20 0.35
HSD17B10 Q99714 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
SCHEMBL18107065 0.85 ALDH1A1 (0.50) ALDH1A1TP53HIF1ACYP3A4MAPK1
SCHEMBL29363961 0.84 TSHR (0.45) ALDH1A1TP53HIF1ACYP3A4MAPK1
SCHEMBL30102503 0.84 TSHR (0.45) ALDH1A1TP53HIF1ACYP3A4MAPK1
SCHEMBL345924 0.84
SCHEMBL28545026 0.84 ALDH1A1 (0.40) ALDH1A1TP53HIF1ACYP3A4MAPK1
Ethylene Glycol SCHEMBL11678086 0.83 TSHR (0.45) ALDH1A1TP53HIF1ACYP3A4MAPK1
Propane SCHEMBL10776997 0.82 TSHR (0.43) ALDH1A1TP53HIF1ACYP3A4MAPK1
Ammonia Solution, Strong SCHEMBL27716327 0.82
Acrylic Acid Ethyl Ester SCHEMBL7163801 0.81 ALDH1A1 (0.60) ALDH1A1TP53HIF1ACYP3A4MAPK1
Acrylic Acid Ethyl Ester SCHEMBL11105086 0.81 ALDH1A1 (0.60) ALDH1A1TP53HIF1ACYP3A4MAPK1

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
WO-1987005540-A1 SHRINKAGE-RESISTANT ULTRAVIOLET-CURING COATINGS DESOTO, INC. (US) 1987-09-24 WO claimed
US-4657779-A MIXTURES OF EPOXIES AND HYDROXY-CONTAINING ACRYLATES WITH A PHOTOSENSITIVE DIFUNCTIONAL CATALYST DESOTO, INC. (US) 1987-04-14 US claimed
EP-0948412-A4 ELECTROGRAPHIC IMAGING ELEMENT REXAM GRAPHICS INC (US) 2000-09-20 EP disclosed
US-6048604-A ETHYLENICALLY UNSATURATED AMMONIUM PRECURSORS, REXAM GRAPHICS, INC. (US) 2000-04-11 US disclosed
WO-1999062445-A1 DIRECT WRITE ELECTROGRAPHIC WALLCOVERING REXAM GRAPHICS, INC. (US) 1999-12-09 WO disclosed
EP-0948412-A1 ELECTROGRAPHIC IMAGING ELEMENT Rexam Graphics Inc. (US) 1999-10-13 EP disclosed
WO-1998026879-A1 ELECTROGRAPHIC IMAGING ELEMENT REXAM GRAPHICS, INC. (US) 1998-06-25 WO disclosed
US-5759636-A LARGE SCALE, PHOTOPOLYMERIZATION, CATIONIC POLYMERS REXAM GRAPHICS, INC. (US) 1998-06-02 US disclosed
WO-1987005540-A1 SHRINKAGE-RESISTANT ULTRAVIOLET-CURING COATINGS DESOTO, INC. (US) 1987-09-24 WO disclosed
US-4657779-A MIXTURES OF EPOXIES AND HYDROXY-CONTAINING ACRYLATES WITH A PHOTOSENSITIVE DIFUNCTIONAL CATALYST DESOTO, INC. (US) 1987-04-14 US disclosed