SCHEMBL9505710

SCHEMBL9505710

C=CC(=O)OCC(CO)OC(=O)C=O

nearest known ligand 0.53

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.48
PRKCA P17252 4/20 0.41
ALDH1A1 P00352 3/20 0.39
TP53 P04637 2/20 0.39
CYP3A4 P08684 2/20 0.39
HIF1A Q16665 2/20 0.39
MAPK1 P28482 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39

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
SCHEMBL707088 0.91 TSHR (0.53) TSHRPRKCAALDH1A1TP53CYP3A4
SCHEMBL9668645 0.89 TSHR (0.52) TSHRPRKCAALDH1A1TP53CYP3A4
SCHEMBL7790000 0.84 TSHR (0.50) TSHRPRKCAALDH1A1TP53CYP3A4
SCHEMBL700993 0.81 TSHR (0.59) TSHRPRKCAALDH1A1TP53CYP3A4
Methacrylic Acid SCHEMBL27698597 0.80 TSHR (0.47) TSHRPRKCA
SCHEMBL1444732 0.80 PRKCA (0.42) TSHRPRKCAALDH1A1TP53CYP3A4
SCHEMBL11683061 0.79 PRKCA (0.47) TSHRPRKCA
SCHEMBL6845438 0.79 PRKCA (0.41) TSHRPRKCAALDH1A1TP53CYP3A4
SCHEMBL336611 0.78 TSHR (0.49) TSHRPRKCA
SCHEMBL9505705 0.78 TSHR (0.49) TSHRPRKCA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0384091-B1 GLYCEROL DERIVATIVES, THEIR PREPARATION PROCESS, CROSS-LINKING COMPOSITIONS CONTAINING THEM AND THEIR USE IN THE TEXTILE INDUSTRY SOCIETE FRANCAISE HOECHST (FR) 1993-07-14 EP claimed
US-5157090-A Glycerol derivatives, their preparation process, cross-linking compositions containing them, and their use in the textile industry SOCIETE FRANCAISE HOECHST (FR) 1992-10-20 US claimed
US-5093518-A Crease resistance, solvent resistance, wear resistance SOCIETE FRANCAISE HOECHST (FR) 1992-03-03 US claimed
JP-2235847-A None JP disclosed
US-5157090-A Glycerol derivatives, their preparation process, cross-linking compositions containing them, and their use in the textile industry SOCIETE FRANCAISE HOECHST (FR) 1992-10-20 US disclosed
US-5093518-A Crease resistance, solvent resistance, wear resistance SOCIETE FRANCAISE HOECHST (FR) 1992-03-03 US disclosed
JP-H02235847-A NOVEL GLYCEROL DERIVATIVE, PRODUCTION THEREOF, CROSSLINKING COMPOSITION CONTAINING THE SAME, AND USE THEREOF IN TEXTILE INDUSTRY SOC FR HOECHST 1990-09-18 JP disclosed