Acrylic Acid

Acrylic Acid

SCHEMBL6169907

C=CC(=O)O.CCCC(=O)OC(=O)c1cc([N+](=O)[O-])c(F)c(Cl)c1F

nearest known ligand 0.36

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.36
COMT P21964 2/20 0.34
BCL9 O00512 1/20 0.33
CTNNB1 P35222 1/20 0.33
POLB P06746 2/20 0.32
GALR2 O43603 1/20 0.32
MITF O75030 1/20 0.32
ALDH1A1 P00352 1/20 0.32
LMNA P02545 1/20 0.32
HSP90AA1 P07900 1/20 0.32
HPGD P15428 1/20 0.32
XBP1 P17861 1/20 0.32
CCR6 P51684 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
PDGFRB P09619 1/20 0.32
FGFR1 P11362 1/20 0.32
PDGFRA P16234 1/20 0.32
FLT1 P17948 1/20 0.32
FGFR3 P22607 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
SCHEMBL1003415 0.92 L3MBTL1 (0.41) L3MBTL1COMTBCL9CTNNB1POLB
Acrylic Acid SCHEMBL6169912 0.79 LMNA (0.38) POLBGALR2MITFALDH1A1LMNA
SCHEMBL9824312 0.75 ALDH1A1 (0.40) L3MBTL1COMTALDH1A1LMNAHPGD
SCHEMBL4468894 0.73 ALDH1A1 (0.38) COMTALDH1A1LMNAHPGD
SCHEMBL1004696 0.70 DTYMK (0.42) ALDH1A1LMNAHPGD
SCHEMBL1003801 0.69 ALDH1A1 (0.43) POLBGALR2MITFALDH1A1LMNA
SCHEMBL1002537 0.69 GPR35 (0.42) ALDH1A1HPGDWDR5
SCHEMBL4466462 0.68 ALDH1A1 (0.40) ALDH1A1
SCHEMBL1186952 0.67 ALDH1A1 (0.45) ALDH1A1LMNAHPGDSMN1; SMN2
SCHEMBL10472450 0.67 ALDH1A1 (0.39) COMTPOLBALDH1A1LMNAHPGD

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
EP-1532137-A2 ANTIMICROBIAL AZA-BICYCLIC DERIVATES, THEIR COMPOSITIONS AND USES THE PROCTER & GAMBLE COMPANY (US) 2005-05-25 EP disclosed
WO-2004014893-A2 ANTIMICROBIAL AZA-BICYCLIC DERIVATES, THEIR COMPOSITIONS AND USES THE PROCTER & GAMBLE COMPANY (US) 2004-02-19 WO disclosed