SCHEMBL7735335

SCHEMBL7735335

CC(=O)Oc1ccc(CC(=O)O)cc1.CC(=O)Oc1ccc(CCC(=O)O)cc1

nearest known ligand 0.54

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 13/20 0.54
LMNA P02545 1/20 0.54
L3MBTL1 Q9Y468 1/20 0.54
SRD5A2 P31213 1/20 0.51
FFAR4 Q5NUL3 3/20 0.50
GAA P10253 1/20 0.49
ALDH1A1 P00352 2/20 0.49
HPGD P15428 1/20 0.49
HSD17B10 Q99714 1/20 0.49

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
SCHEMBL2635246 0.93 FFAR1 (0.61) FFAR1LMNAL3MBTL1SRD5A2FFAR4
SCHEMBL384743 0.90 GAA (0.57) LMNASRD5A2GAAALDH1A1HPGD
SCHEMBL11489461 0.88 GAA (0.55) LMNASRD5A2GAAALDH1A1HPGD
SCHEMBL29833587 0.83 LMNA (0.69) LMNAL3MBTL1SRD5A2GAAALDH1A1
SCHEMBL12469379 0.83 FFAR1 (0.65) FFAR1LMNAL3MBTL1SRD5A2FFAR4
SCHEMBL28953591 0.82 FFAR1 (0.68) FFAR1LMNAFFAR4GAAALDH1A1
SCHEMBL11318819 0.82 FFAR1 (0.68) FFAR1LMNAFFAR4GAAALDH1A1
SCHEMBL1114413 0.82 MAPT (0.56) FFAR1LMNAL3MBTL1HSD17B10
SCHEMBL29674918 0.82 KMT2A (0.55) LMNASRD5A2GAAHSD17B10
4-(Acetate)Acetophenone SCHEMBL30735795 0.82 SRD5A2 (0.55) LMNAL3MBTL1SRD5A2GAAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6409937-B1 4-HYDROXYPHENYLACETIC ACID, 3-(4-HYDROXYPHENYL)PROPIONIC ACID, TEREPHTHALIC ACID, HYDROQUINONE, 2,6-NAPHTHALENE DIOL, 4,4'-BIPHENOL; ACETYLATION, HYDROLYSIS AT REDUCED PRESSURE FOR EFFICIENT ACETIC ACID REMOVAL AND HIGHER MOLECULAR WEIGHT COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2002-06-25 US disclosed