Acrylic Acid

Acrylic Acid

SCHEMBL18580799

C=CC(=O)O.O=C(c1ccccc1C1(O)CCCCC1)c1ccccc1C1(O)CCCCC1

nearest known ligand 0.38

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKR1C1 Q04828 1/20 0.38
HDAC4 P56524 4/20 0.36
KMT2A Q03164 3/20 0.35
MEN1 O00255 2/20 0.35
ALDH1A1 P00352 2/20 0.35
POLB P06746 1/20 0.35
KDM5A P29375 1/20 0.34
KDM4C Q9H3R0 1/20 0.34
KDM5B Q9UGL1 1/20 0.34
AKT1 P31749 1/20 0.33
KDM4E B2RXH2 2/20 0.33
TET3 O43151 1/20 0.33
FBXL19 Q6PCT2 1/20 0.33
CXXC5 Q7LFL8 1/20 0.33
TET1 Q8NFU7 1/20 0.33
KDM2B Q8NHM5 1/20 0.33
CXXC4 Q9H2H0 1/20 0.33
KDM2A Q9Y2K7 1/20 0.33
P2RX7 Q99572 1/20 0.32
SMN1; SMN2 Q16637 1/20 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
Acrylic Acid SCHEMBL27666998 0.93 AKR1C3 (0.40) AKR1C1HDAC4KMT2AMEN1ALDH1A1
SCHEMBL29359244 0.89 AKR1C1 (0.41) AKR1C1HDAC4KMT2AMEN1P2RX7
SCHEMBL27281 0.89 AKR1C1 (0.41) AKR1C1HDAC4KMT2AMEN1P2RX7
SCHEMBL29780569 0.87 AKR1C1 (0.40) AKR1C1HDAC4KMT2AMEN1P2RX7
Iodide SCHEMBL30367011 0.87 AKR1C1 (0.40) AKR1C1HDAC4KMT2AMEN1P2RX7
Benzophenone SCHEMBL3626603 0.84 ALDH1A1 (0.45) AKR1C1HDAC4KMT2AMEN1ALDH1A1
SCHEMBL323272 0.83 AKR1C3 (0.47) AKR1C1HDAC4ALDH1A1KDM4ESMN1; SMN2
SCHEMBL29686125 0.82 AKR1C1 (0.38) AKR1C1HDAC4KMT2AMEN1KDM5A
SCHEMBL20573606 0.79 HDAC4 (0.38) AKR1C1HDAC4KMT2AMEN1ALDH1A1
SCHEMBL27556884 0.78 KMT2A (0.39) AKR1C1HDAC4KMT2AMEN1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9896529-B2 Method for producing polyacrylic acid (salt)-based water-absorbable resin NIPPON SHOKUBAI CO., LTD. (JP) 2018-02-20 US disclosed
US-20170066862-A1 METHOD FOR PRODUCING POLYACRYLIC ACID (SALT)-BASED WATER-ABSORBABLE RESIN NIPPON SHOKUBAI CO., LTD. (JP) 2017-03-09 US disclosed