Acrylic Acid Ethyl Ester

Acrylic Acid Ethyl Ester

SCHEMBL7204831

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

nearest known ligand 0.71

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Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TSHR P16473 8/20 0.71
HPGD P15428 1/20 0.71
ALDH1A1 P00352 5/20 0.52
CYP3A4 P08684 1/20 0.52
ATM Q13315 1/20 0.50
HCAR2 Q8TDS4 4/20 0.49
TP53 P04637 2/20 0.43
HIF1A Q16665 2/20 0.43
HSD17B10 Q99714 1/20 0.43
THRB P10828 3/20 0.41
MAPT P10636 1/20 0.40
RAB9A P51151 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40

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
Methacrylic Acid SCHEMBL168599 0.95 TSHR (0.79) TSHRHPGDALDH1A1CYP3A4ATM
Methacrylic Acid SCHEMBL2152133 0.95 TSHR (0.79) TSHRHPGDALDH1A1CYP3A4ATM
Acrylic Acid Ethyl Ester SCHEMBL8607716 0.94 TSHR (0.63) TSHRHPGDALDH1A1CYP3A4ATM
Methacrylic Acid SCHEMBL31736000 0.93 TSHR (0.76) TSHRHPGDALDH1A1CYP3A4ATM
Methacrylic Acid SCHEMBL10811974 0.93 TSHR (0.76) TSHRHPGDALDH1A1CYP3A4ATM
Methacrylic Acid SCHEMBL5864544 0.93 TSHR (0.76) TSHRHPGDALDH1A1CYP3A4ATM
Methacrylic Acid SCHEMBL11308304 0.92 TSHR (0.73) TSHRHPGDALDH1A1CYP3A4ATM
Acrylic Acid Ethyl Ester SCHEMBL3462761 0.92 TSHR (0.73) TSHRHPGDALDH1A1CYP3A4ATM
Acrylic Acid Ethyl Ester SCHEMBL10657106 0.92 TSHR (0.59) TSHRHPGDALDH1A1CYP3A4ATM
Acrylic Acid Ethyl Ester SCHEMBL27774266 0.92 TSHR (0.59) TSHRHPGDALDH1A1CYP3A4ATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6602489-B2 Concentrate blend; fine spray; miniaturized container WELLA AG (DE) 2003-08-05 US disclosed
US-20020150542-A1 Compact hairspray product consisting of hairspray concentrate, container and fine spray pump with pre-pressurization Wella GmbH (DE) 2002-10-17 US disclosed
EP-0567327-A2 Gas barrier melt processable polymer blends ROHM AND HAAS COMPANY (US) 1993-10-27 EP disclosed
US-5182044-A Containing a (meth)acrylate copolymer LION CORPORATION (JP) 1993-01-26 US disclosed
EP-0459077-A1 Zeolite containing liquid detergent composition LION CORPORATION (JP) 1991-12-04 EP disclosed