Acrylic Acid Methyl Ester

Acrylic Acid Methyl Ester

SCHEMBL7050831

C=CC(=O)O.C=CC(=O)OC.C=CC(=O)OC.C=CC(=O)OCCCC

nearest known ligand 0.76

Full drug profile on Sugi Atlas →

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TSHR P16473 7/20 0.76
HPGD P15428 1/20 0.76
HCAR2 Q8TDS4 4/20 0.56
ALDH1A1 P00352 4/20 0.55
CYP3A4 P08684 1/20 0.55
ATM Q13315 1/20 0.53
TP53 P04637 2/20 0.46
HIF1A Q16665 2/20 0.46
HSD17B10 Q99714 1/20 0.46
MAPT P10636 1/20 0.45
RAB9A P51151 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
THRB P10828 3/20 0.42
EPHX1 P07099 1/20 0.37

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
Acrylic Acid Methyl Ester SCHEMBL27820526 0.95 TSHR (0.85) TSHRHPGDHCAR2ALDH1A1CYP3A4
Acrylic Acid Methyl Ester SCHEMBL163438 0.95 TSHR (0.85) TSHRHPGDHCAR2ALDH1A1CYP3A4
Acrylic Acid Methyl Ester SCHEMBL5925204 0.93 TSHR (0.66) TSHRHPGDHCAR2ALDH1A1CYP3A4
Acrylic Acid Methyl Ester SCHEMBL28760540 0.93 TSHR (0.81) TSHRHPGDHCAR2ALDH1A1CYP3A4
Acrylic Acid SCHEMBL1033201 0.93 TSHR (0.88) TSHRHPGDHCAR2ALDH1A1CYP3A4
Acrylic Acid SCHEMBL28508000 0.93 TSHR (0.88) TSHRHPGDHCAR2ALDH1A1CYP3A4
Acrylic Acid SCHEMBL5370100 0.91 TSHR (0.85) TSHRHPGDHCAR2ALDH1A1CYP3A4
Acrylic Acid Methyl Ester SCHEMBL2576298 0.90 TSHR (0.76) TSHRHPGDHCAR2ALDH1A1CYP3A4
Acrylic Acid Ethyl Ester SCHEMBL11681184 0.90 TSHR (0.76) TSHRHPGDHCAR2ALDH1A1CYP3A4
Acrylic Acid SCHEMBL11329135 0.89 TSHR (0.81) TSHRHPGDHCAR2ALDH1A1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0614418-B2 MINERAL-LIKE PLASTICS GHAHARY AKBAR (US) 2003-04-16 EP disclosed
EP-0614418-B1 MINERAL-LIKE PLASTICS GHAHARY AKBAR (US) 1998-07-08 EP disclosed
US-5304592-A Plastic material suspended in thermoplastic matrix SAFAS CORPORATION 1994-04-19 US disclosed