SCHEMBL8055248

SCHEMBL8055248

C=C(O)C(=O)O.OCC(CO)(CO)CO

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.36
TP53 P04637 1/20 0.36
CYP3A4 P08684 1/20 0.36
MAPK1 P28482 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
HIF1A Q16665 1/20 0.36
TSHR P16473 2/20 0.33
OR51E2 Q9H255 1/20 0.33
GRIK1 P39086 1/20 0.33
GRIK2 Q13002 1/20 0.33
GRM1 Q13255 1/20 0.33
GRM2 Q14416 1/20 0.33
TET2 Q6N021 2/20 0.32

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
Oxalic Acid SCHEMBL194974 0.83 ALDH1A1 (0.39) ALDH1A1TP53CYP3A4MAPK1SMN1; SMN2
SCHEMBL8194118 0.82 ALDH1A1 (0.33) ALDH1A1TP53CYP3A4MAPK1SMN1; SMN2
Methacrylic Acid SCHEMBL2231460 0.82 TDP1 (0.36) ALDH1A1TP53CYP3A4MAPK1SMN1; SMN2
Methacrylic Acid SCHEMBL60307 0.82 TDP1 (0.36) ALDH1A1TP53CYP3A4MAPK1SMN1; SMN2
SCHEMBL11807030 0.82 ALDH1A1 (0.33) ALDH1A1TP53CYP3A4MAPK1SMN1; SMN2
Methacrylic Acid SCHEMBL59116 0.82 TDP1 (0.36) ALDH1A1TP53CYP3A4MAPK1SMN1; SMN2
Methacrylic Acid SCHEMBL609551 0.82 TDP1 (0.36) ALDH1A1TP53CYP3A4MAPK1SMN1; SMN2
Methacrylic Acid SCHEMBL1901678 0.82 TDP1 (0.36) ALDH1A1TP53CYP3A4MAPK1SMN1; SMN2
Methacrylic Acid SCHEMBL215989 0.82 TDP1 (0.36) ALDH1A1TP53CYP3A4MAPK1SMN1; SMN2
Methacrylic Acid SCHEMBL18109766 0.82 TDP1 (0.36) ALDH1A1TP53CYP3A4MAPK1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6031046-A A LOW MOLECULAR WEIGHT ADDITIVE, A MULTIFUNCTIONAL POLYACRYLATE ALIPHATIC POLYURETHANE OLIGOMER TO PRODUCE CURED POLYMERS AND CURED POLYMER PRODUCTS HEBR INTERNATIONAL INC. (US) 2000-02-29 US disclosed
US-5863997-A Multifunctional polyacrylate-polyurethane oligomer HEHR INTERNATIONAL INC. (US) 1999-01-26 US disclosed
WO-1998021250-A1 MULTIFUNCTIONAL POLYACRYLATE-POLYURETHANE OLIGOMER, METHOD AND CURED POLYMERS AND PRODUCTS HEHR INTERNATIONAL INC. (US) 1998-05-22 WO disclosed
US-5741872-A CURED LAMINATE PRODUCTS HEHR INTERNATIONAL INC. (US) 1998-04-21 US disclosed