Acrylic Acid

Acrylic Acid

SCHEMBL14760404

C=CC(=O)O.C=COC(=O)C(C)(C)CCCCCC

nearest known ligand 0.41

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 1/20 0.41
CYP4A11 Q02928 1/20 0.41
ACLY P53396 1/20 0.38
ZDHHC20 Q5W0Z9 1/20 0.37
ZDHHC2 Q9UIJ5 1/20 0.37
CYP3A4 P08684 2/20 0.36
GMNN O75496 1/20 0.36
USP2 O75604 1/20 0.36
CYP1A2 P05177 1/20 0.36
POLB P06746 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C9 P11712 1/20 0.36
APEX1 P27695 1/20 0.36
CYP2C19 P33261 1/20 0.36
RECQL P46063 1/20 0.36
BLM P54132 1/20 0.36
HSD17B10 Q99714 1/20 0.36
TSHR P16473 3/20 0.35
HPGD P15428 1/20 0.35
HCAR2 Q8TDS4 1/20 0.35

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
SCHEMBL7051547 0.94 CYP4F2 (0.46) CYP4F2CYP4A11ACLYZDHHC20ZDHHC2
SCHEMBL19469710 0.94 CYP4F2 (0.46) CYP4F2CYP4A11ACLYZDHHC20ZDHHC2
SCHEMBL35755 0.94 CYP4F2 (0.46) CYP4F2CYP4A11ACLYZDHHC20ZDHHC2
SCHEMBL15416699 0.92 CYP4F2 (0.43) CYP4F2CYP4A11ACLYZDHHC20ZDHHC2
SCHEMBL9343712 0.88 CYP4F2 (0.45) CYP4F2CYP4A11ACLYZDHHC20ZDHHC2
SCHEMBL7194742 0.87 CYP4F2 (0.41) CYP4F2CYP4A11ACLYZDHHC20ZDHHC2
SCHEMBL245767 0.85 TSHR (0.50) CYP4F2CYP4A11POLBTSHRMAPT
SCHEMBL31443245 0.81 CYP4F2 (0.37) CYP4F2CYP4A11ZDHHC20ZDHHC2CYP3A4
SCHEMBL6231011 0.80 CA2 (0.45) CYP4F2CYP4A11TSHRMAPTMEN1
SCHEMBL24059245 0.80 TSHR (0.39) ZDHHC20ZDHHC2CYP3A4GMNNUSP2

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
EP-2567999-B1 Silicone containing compositions and uses thereof AIR PROD & CHEM (US) 2014-07-02 EP disclosed
US-8735524-B2 Silicone containing compositions and uses thereof AIR PRODUCTS AND CHEMICALS, INC. (US) 2014-05-27 US disclosed
US-20130065998-A1 Silicone Containing Compositions and Uses Thereof AIR PRODUCTS AND CHEMICALS, INC. (US) 2013-03-14 US disclosed
EP-2567999-A1 Silicone containing compositions and uses thereof Air Products and Chemicals, Inc. (US) 2013-03-13 EP disclosed