Acrylic Acid

Acrylic Acid

SCHEMBL8083638

C=C(C)C(=O)OCCO.C=CC(=O)O.C=CC(=O)OCC(CC)CCCC

nearest known ligand 0.66

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 8/20 0.66
CYP3A4 P08684 4/20 0.42
TDP1 Q9NUW8 2/20 0.42
ATM Q13315 1/20 0.42
HPGD P15428 1/20 0.40
ALDH1A1 P00352 4/20 0.38
CA2 P00918 1/20 0.38
RECQL P46063 1/20 0.37
LMNA P02545 3/20 0.36
MAPK1 P28482 2/20 0.36
HSD17B10 Q99714 1/20 0.35
PRSS1 P07477 1/20 0.34
PRSS2 P07478 1/20 0.34
PRSS3 P35030 1/20 0.34
THRB P10828 1/20 0.34
MMP9 P14780 1/20 0.33
MMP8 P22894 1/20 0.33
MMP14 P50281 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
HCAR2 Q8TDS4 1/20 0.33

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
SCHEMBL29026123 0.96 TSHR (0.71) TSHRCYP3A4TDP1ATMHPGD
SCHEMBL10773417 0.93 TSHR (0.66) TSHRCYP3A4TDP1ATMHPGD
SCHEMBL10477292 0.92 TSHR (0.67) TSHRCYP3A4TDP1ATMHPGD
Ethylene Glycol SCHEMBL6060432 0.91 TSHR (0.65) TSHRCYP3A4TDP1ATMHPGD
SCHEMBL11407971 0.91 TSHR (0.69) TSHRCYP3A4TDP1ATMHPGD
Acrylic Acid SCHEMBL29291566 0.91 TSHR (0.76) TSHRCYP3A4TDP1ATMHPGD
SCHEMBL6133740 0.90 TSHR (0.62) TSHRCYP3A4TDP1ATMHPGD
SCHEMBL4901912 0.89 TSHR (0.74) TSHRCYP3A4TDP1ATMHPGD
SCHEMBL9065069 0.88 TSHR (0.81) TSHRCYP3A4TDP1ATMHPGD
Styrene SCHEMBL8083641 0.88 TSHR (0.56) TSHRCYP3A4TDP1ATMHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1041434-A1 Heat-developable photosensitive material FUJI PHOTO FILM CO., LTD. (JP) 2000-10-04 EP disclosed