Acrylic Acid

Acrylic Acid

SCHEMBL7905472

C=CC(=O)O.CC(=O)OC(C)=O.Cc1cccc(O)c1[N+](=O)[O-]

nearest known ligand 0.46

Full drug profile on Sugi Atlas →

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.46
TDP1 Q9NUW8 2/20 0.46
TSHR P16473 1/20 0.42
GPR35 Q9HC97 1/20 0.42
HPGD P15428 4/20 0.39
POLB P06746 4/20 0.39
L3MBTL1 Q9Y468 1/20 0.38
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
KCNMA1 Q12791 1/20 0.36
RAB9A P51151 1/20 0.36
MAPT P10636 2/20 0.36
MAPK1 P28482 1/20 0.36
BMP1 P13497 1/20 0.35
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
LMNA P02545 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
SCHEMBL91306 0.80 TDP1 (0.72) ALDH1A1TDP1TSHRGPR35HPGD
SCHEMBL29385945 0.80 TDP1 (0.72) ALDH1A1TDP1TSHRGPR35HPGD
Phenol SCHEMBL11794878 0.75 ALDH1A1 (0.60) ALDH1A1TDP1TSHRGPR35HPGD
SCHEMBL7904388 0.74 ALDH1A1 (0.44) ALDH1A1TDP1TSHRGPR35HPGD
Acrylic Acid SCHEMBL7905470 0.72 HPGD (0.35) ALDH1A1TDP1TSHRHPGDPOLB
SCHEMBL16956299 0.70 ALDH1A1 (0.56) ALDH1A1TDP1TSHRHPGDPOLB
SCHEMBL16951592 0.70 GPR35 (0.50) ALDH1A1TDP1TSHRGPR35HPGD
SCHEMBL30972329 0.70 GPR35 (0.50) ALDH1A1TDP1TSHRGPR35HPGD
Orthocresol SCHEMBL2471903 0.69 AKT1 (0.43) ALDH1A1TSHRHPGDMEN1KMT2A
Acrylic Acid SCHEMBL27545092 0.69 HSD17B10 (0.69) ALDH1A1TDP1TSHRPOLBL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6203708-B1 FOR REMOVING SOLUBLE ELECTROLYTES FROM AN IONISING SOLVENT MONASH UNIVERSITY (AU) 2001-03-20 US claimed
EP-0647160-B1 ION EXCHANGE RESIN UNIV MONASH (AU) 1998-09-02 EP claimed
WO-1995018159-A1 ION EXCHANGE RESINS MONTECH PTY. LTD. (AU) 1995-07-06 WO claimed
US-6203708-B1 FOR REMOVING SOLUBLE ELECTROLYTES FROM AN IONISING SOLVENT MONASH UNIVERSITY (AU) 2001-03-20 US disclosed
EP-0647160-B1 ION EXCHANGE RESIN UNIV MONASH (AU) 1998-09-02 EP disclosed
EP-0647160-A4 ION EXCHANGE RESIN. UNIV MONASH (AU) 1995-08-30 EP disclosed
WO-1995018159-A1 ION EXCHANGE RESINS MONTECH PTY. LTD. (AU) 1995-07-06 WO disclosed
EP-0647160-A1 ION EXCHANGE RESIN MONASH UNIVERSITY (AU) 1995-04-12 EP disclosed
WO-1994000237-A1 ION EXCHANGE RESIN MONASH UNIVERSITY (AU) 1994-01-06 WO disclosed