Butyric Acid

Butyric Acid

SCHEMBL6858221

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

nearest known ligand 0.50

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR3 O14843 1/20 0.50
HDAC3 O15379 1/20 0.50
HDAC1 Q13547 1/20 0.50
HDAC2 Q92769 1/20 0.50
HDAC8 Q9BY41 1/20 0.50
AKR1B1 P15121 1/20 0.35
FFAR4 Q5NUL3 2/20 0.35
FFAR1 O14842 2/20 0.35
GPR84 Q9NQS5 7/20 0.34
PPARG P37231 7/20 0.34
PPARD Q03181 7/20 0.34
PPARA Q07869 7/20 0.34
HDAC11 Q96DB2 5/20 0.34
TSHR P16473 4/20 0.34
PTPN1 P18031 3/20 0.34
ALDH1A1 P00352 2/20 0.34
TLR2 O60603 2/20 0.34
TDP1 Q9NUW8 2/20 0.34
FABP4 P15090 2/20 0.34
SLC22A6 Q4U2R8 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
Butyric Acid SCHEMBL5854877 0.82 FFAR3 (0.56) FFAR3HDAC3HDAC1HDAC2HDAC8
Butyric Acid SCHEMBL9694636 0.80 FFAR3 (0.54) FFAR3HDAC3HDAC1HDAC2HDAC8
SCHEMBL482698 0.79 TP53 (0.38)
SCHEMBL308149 0.79 TP53 (0.38)
SCHEMBL500636 0.78 TRPA1 (0.32) TSHRTDP1
Acetoacetic Acid SCHEMBL28678053 0.77 ALDH1A1 (0.33) ALDH1A1TDP1
Butyric Acid SCHEMBL4578587 0.76 FFAR3 (0.77) FFAR3HDAC3HDAC1HDAC2HDAC8
Butyric Acid SCHEMBL8908724 0.76 FFAR3 (0.77) FFAR3HDAC3HDAC1HDAC2HDAC8
Methacrylic Acid SCHEMBL8956104 0.74 TSHR (0.35) TSHRALDH1A1TDP1
Glutarate SCHEMBL6064084 0.74 SLC22A6 (0.39) AKR1B1FFAR4FFAR1GPR84PPARG

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
US-6833414-B2 For use in paints and coatings ARKEMA INC. 2004-12-21 US disclosed
US-20030204018-A1 For use in paints and coatings ARKEMA INC. 2003-10-30 US disclosed
EP-1335007-A1 Cross-linkable aqueous fluoropolymer based dispersions containing silanes Atofina Chemicals, Inc. (US) 2003-08-13 EP disclosed