Acrylic Acid

Acrylic Acid

SCHEMBL8040754

C=CC(=O)O.C=CC(=O)O.CC(C)(CO)COC(=O)CCCCC(=O)O

nearest known ligand 0.37

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.37
ABCC4 O15439 1/20 0.36
MAPT P10636 1/20 0.36
PAM P19021 2/20 0.36
ALDH1A1 P00352 4/20 0.34
CYP3A4 P08684 2/20 0.34
TP53 P04637 1/20 0.34
MAPK1 P28482 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
HIF1A Q16665 1/20 0.34
P2RY10 O00398 1/20 0.34
GPR34 Q9UPC5 1/20 0.34
LMNA P02545 3/20 0.33
GPR84 Q9NQS5 2/20 0.32
FFAR1 O14842 1/20 0.32
FFAR4 Q5NUL3 1/20 0.32
AKR1B1 P15121 1/20 0.32
NFKB1 P19838 1/20 0.32
PMP22 Q01453 1/20 0.32
GMNN O75496 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
SCHEMBL230981 0.91 TSHR (0.44) TSHRPAMALDH1A1LMNAGPR84
SCHEMBL8594577 0.89 PAM (0.44) TSHRPAMALDH1A1LMNAGPR84
SCHEMBL8522424 0.89 PAM (0.44) TSHRPAMALDH1A1LMNAGPR84
1,4-Butanediol SCHEMBL3703747 0.86 GPR84 (0.48) TSHRPAMALDH1A1LMNAGPR84
1,6-Hexanediol SCHEMBL2487661 0.84 GPR84 (0.52) TSHRPAMALDH1A1LMNAGPR84
Adipic Acid SCHEMBL29530543 0.84 ABCC4 (0.45) TSHRABCC4MAPTALDH1A1LMNA
Adipic Acid SCHEMBL6753930 0.84 ABCC4 (0.45) TSHRABCC4MAPTALDH1A1LMNA
SCHEMBL274635 0.83 DGKA (0.42) TSHRMAPTPAMALDH1A1CYP3A4
Dodecane SCHEMBL11247063 0.83 PAM (0.56) TSHRMAPTPAMALDH1A1GPR84
Butyl Alcohol SCHEMBL11037336 0.82 PAM (0.46) TSHRPAMALDH1A1GPR84FFAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0762208-B1 Light sensitive composition KONISHIROKU PHOTO IND (JP) 2000-04-12 EP disclosed
US-5773194-A PHOTOSENSITIVITY; DURABILITY KONICA CORPORATION (JP) 1998-06-30 US disclosed
EP-0762208-A2 Light sensitive composition, presensitized lithographic printing plate and image forming method employing the printing plate KONICA CORPORATION (JP) 1997-03-12 EP disclosed