Butyric Acid

Butyric Acid

SCHEMBL1866744

CCC=CCCOC(=O)CCC.CCCC(=O)O

nearest known ligand 0.50

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.50
MAPT P10636 6/20 0.50
CYP19A1 P11511 5/20 0.50
PPARG P37231 5/20 0.50
OXER1 Q8TDS5 3/20 0.50
RXRA P19793 2/20 0.50
FFAR1 O14842 2/20 0.50
F7 P08709 5/20 0.47
F3 P13726 5/20 0.47
PPARD Q03181 4/20 0.47
PPARA Q07869 4/20 0.47
ADORA3 P0DMS8 3/20 0.47
PTGS1 P23219 3/20 0.47
KMT2A Q03164 3/20 0.47
NR1I2 O75469 2/20 0.46
PTGS2 P35354 2/20 0.46
PGR P06401 2/20 0.46
PDE4D Q08499 1/20 0.46
FFAR3 O14843 1/20 0.45
HDAC3 O15379 1/20 0.45

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 SCHEMBL1866742 1.00 ALDH1A1 (0.50) ALDH1A1MAPTCYP19A1PPARGOXER1
SCHEMBL309026 0.93 ADORA3 (0.51) ALDH1A1MAPTCYP19A1PPARGOXER1
SCHEMBL309027 0.93 ADORA3 (0.51) ALDH1A1MAPTCYP19A1PPARGOXER1
SCHEMBL3944018 0.93 ADORA3 (0.51) ALDH1A1MAPTCYP19A1PPARGOXER1
Acetic Acid SCHEMBL31534018 0.91 ADORA3 (0.47) ALDH1A1MAPTCYP19A1PPARGOXER1
SCHEMBL5728092 0.89 ALDH1A1 (0.53) ALDH1A1MAPTCYP19A1PPARGOXER1
SCHEMBL5728091 0.89 ALDH1A1 (0.53) ALDH1A1MAPTCYP19A1PPARGOXER1
SCHEMBL29255856 0.88 ADORA3 (0.60) ALDH1A1MAPTCYP19A1PPARGOXER1
SCHEMBL22832723 0.85 ADORA3 (0.55) ALDH1A1MAPTCYP19A1PPARGOXER1
SCHEMBL22832722 0.85 ADORA3 (0.55) ALDH1A1MAPTCYP19A1PPARGOXER1

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-2496682-A1 DELIVERY PARTICLE The Procter & Gamble Company (US) 2012-09-12 EP disclosed
WO-2011056935-A1 DELIVERY PARTICLE THE PROCTER & GAMBLE COMPANY (US) 2011-05-12 WO disclosed