Acrylic Acid

Acrylic Acid

SCHEMBL4433225

C=CC#N.C=CC(=O)O.C=CC=CC=Cc1ccccc1

nearest known ligand 0.44

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 2/20 0.44
MAOB P27338 4/20 0.44
HDAC3 O15379 3/20 0.42
HDAC4 P56524 3/20 0.42
HDAC1 Q13547 3/20 0.42
HDAC2 Q92769 3/20 0.42
HDAC8 Q9BY41 3/20 0.42
HDAC6 Q9UBN7 3/20 0.42
HDAC7 Q8WUI4 2/20 0.42
HDAC10 Q969S8 2/20 0.42
HDAC11 Q96DB2 2/20 0.42
HDAC9 Q9UKV0 2/20 0.42
HDAC5 Q9UQL6 2/20 0.42
TNKS O95271 1/20 0.42
HCAR2 Q8TDS4 1/20 0.42
TNKS2 Q9H2K2 1/20 0.42
LMNA P02545 4/20 0.40
ALDH1A1 P00352 4/20 0.40
MAPT P10636 3/20 0.40
SMN1; SMN2 Q16637 2/20 0.40

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
Acrylonitrile SCHEMBL8912106 0.94 MAOB (0.47) MCL1MAOBHDAC3HDAC4HDAC1
Acrylonitrile SCHEMBL18347 0.90 MAOB (0.54) MCL1MAOBHDAC3HDAC4HDAC1
Acrylic Acid SCHEMBL1536199 0.90 MAOB (0.54) MCL1MAOBHDAC3HDAC4HDAC1
Juarezic Acid SCHEMBL7761086 0.88 HDAC3 (0.50) MCL1MAOBHDAC3HDAC4HDAC1
Acrylic Acid SCHEMBL8862547 0.85 MAOB (0.48) MCL1MAOBHDAC3HDAC4HDAC1
Acrylic Acid SCHEMBL11151829 0.84 MCL1 (0.44) MCL1MAOBHDAC3HDAC4HDAC1
Juarezic Acid SCHEMBL2246623 0.84 HDAC3 (0.50) MCL1MAOBHDAC3HDAC4HDAC1
Acrylic Acid SCHEMBL1720420 0.84 MAOB (0.47) MCL1MAOBHDAC3HDAC4HDAC1
Acrylic Acid SCHEMBL237879 0.84 MAOB (0.47) MCL1MAOBHDAC3HDAC4HDAC1
Acrylic Acid SCHEMBL8862502 0.84 MAOB (0.47) MCL1MAOBHDAC3HDAC4HDAC1

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
CN-101631913-A Ink fast drying paper WARREN S D CO 2010-01-20 CN disclosed
EP-2118367-A1 RAPID INK DRYING PAPERS S.D. Warren Company (US) 2009-11-18 EP disclosed
WO-2008097883-A1 RAPID INK DRYING PAPERS S.D. WARREN COMPANY (US) 2008-08-14 WO disclosed