Acrylic Acid

Acrylic Acid

SCHEMBL4926728

C=CC(=O)[O-].CCCC[N+](CC)(CCCC)CCCC

nearest known ligand 0.42

Full drug profile on Sugi Atlas →

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SLC22A1 O15245 3/20 0.42
DNM1 Q05193 4/20 0.41
TSHR P16473 2/20 0.38
HPGD P15428 1/20 0.38
SLC22A2 O15244 1/20 0.37
ZDHHC20 Q5W0Z9 1/20 0.36
ZDHHC2 Q9UIJ5 1/20 0.36
CA1 P00915 1/20 0.35
CES2 O00748 1/20 0.34
CES1 P23141 1/20 0.34
ALDH1A1 P00352 1/20 0.34
TP53 P04637 1/20 0.34
CYP3A4 P08684 1/20 0.34
ALOX15 P16050 1/20 0.34
ALOX12 P18054 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
HIF1A Q16665 1/20 0.34
HSD17B10 Q99714 1/20 0.34

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
Tetrabuthylammonium SCHEMBL2351429 0.92 SLC22A1 (0.52) SLC22A1DNM1TSHRHPGDSLC22A2
Acrylic Acid SCHEMBL5912915 0.89 DNM1 (0.59) SLC22A1DNM1TSHRSLC22A2ZDHHC20
Acrylic Acid SCHEMBL5912939 0.89 DNM1 (0.59) SLC22A1DNM1TSHRSLC22A2ZDHHC20
Acrylic Acid SCHEMBL4922524 0.88 SLC22A1 (0.48) SLC22A1TSHRHPGDSLC22A2ZDHHC20
Acrylic Acid SCHEMBL4926761 0.88 SLC22A1 (0.48) SLC22A1TSHRHPGDSLC22A2ZDHHC20
Fumaric Acid SCHEMBL4928123 0.86 SLC22A1 (0.44) SLC22A1DNM1TSHRSLC22A2CA1
Acrylic Acid SCHEMBL9787257 0.86 SLC22A1 (0.54) SLC22A1DNM1TSHRSLC22A2ZDHHC20
Fumaric Acid SCHEMBL4925048 0.86 SLC22A1 (0.44) SLC22A1DNM1TSHRSLC22A2CA1
Tetrahexylammonium SCHEMBL9787454 0.86 SLC22A1 (0.54) SLC22A1DNM1TSHRSLC22A2ZDHHC20
Fumaric Acid SCHEMBL4951034 0.86 SLC22A1 (0.44) SLC22A1DNM1TSHRSLC22A2CA1

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-20080312351-A1 Tetraalkylammonium Carboxylate Salts as Trimerization Catalysts for Spray Foam Applications AIR PRODUCTS AND CHEMICALS, INC. (US) 2008-12-18 US claimed
EP-2003157-A2 Tetraalkylammonium carboxylate salts as trimerization catalysts for spray foam applications Air Products and Chemicals, Inc. (US) 2008-12-17 EP claimed
US-20080312351-A1 Tetraalkylammonium Carboxylate Salts as Trimerization Catalysts for Spray Foam Applications AIR PRODUCTS AND CHEMICALS, INC. (US) 2008-12-18 US disclosed
EP-2003157-A2 Tetraalkylammonium carboxylate salts as trimerization catalysts for spray foam applications Air Products and Chemicals, Inc. (US) 2008-12-17 EP disclosed