SCHEMBL7598159

SCHEMBL7598159

CCCCC(CC)(CO)CO.CCCCC(CC)(CO)CO.Cc1cc(Sc2cc(C)c(O)c(C(C)(C)C)c2)cc(C(C)(C)C)c1O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 5/20 0.40
CYP2C19 P33261 5/20 0.40
CYP1A2 P05177 2/20 0.40
ALOX15 P16050 4/20 0.36
HPN P05981 1/20 0.36
MAPT P10636 1/20 0.36
SIRT5 Q9NXA8 1/20 0.36
HIF1A Q16665 4/20 0.33
TP53 P04637 3/20 0.33
ALDH1A1 P00352 3/20 0.33
CYP3A4 P08684 2/20 0.33
TSHR P16473 2/20 0.33
MAPK1 P28482 2/20 0.33
MEN1 O00255 1/20 0.33
GMNN O75496 1/20 0.33
GABBR2 O75899 1/20 0.33
LMNA P02545 1/20 0.33
NFKB1 P19838 1/20 0.33
BLM P54132 1/20 0.33
PMP22 Q01453 1/20 0.33

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
SCHEMBL27236 0.78 CYP2C9 (0.61) CYP2C9CYP2C19CYP1A2ALOX15HPN
SCHEMBL29362395 0.78 CYP2C9 (0.61) CYP2C9CYP2C19CYP1A2ALOX15HPN
SCHEMBL2793568 0.78 NR5A2 (0.47) CYP2C9CYP2C19CYP1A2ALOX15HPN
Butylated Hydroxytoluene SCHEMBL2952160 0.77 ALDH1A1 (0.50) CYP2C9CYP2C19CYP1A2ALOX15MAPT
SCHEMBL727872 0.75 NR5A2 (0.44) CYP2C9CYP2C19CYP1A2ALOX15HPN
SCHEMBL11262061 0.74 ALDH1A1 (0.55) CYP2C9CYP2C19CYP1A2ALOX15MAPT
Phosphoric Acid SCHEMBL2954109 0.73 NR5A2 (0.48) CYP2C9CYP2C19CYP1A2ALOX15MAPT
SCHEMBL19663281 0.72 CYP2C9 (0.41) CYP2C9CYP2C19CYP1A2ALOX15HPN
SCHEMBL11313082 0.71 ALDH1A1 (0.58) CYP2C9CYP2C19CYP1A2ALOX15MAPT
SCHEMBL2952154 0.69 CYP3A4 (0.34) CYP2C9CYP2C19HIF1AALDH1A1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6451888-B1 Solid stabilizer composition with improved hydrolytic stability GENERAL ELECTRIC COMPANY 2002-09-17 US claimed
EP-0685516-B1 Solid stabilizer composition with improved hydrolytic stability GEN ELECTRIC (US) 1999-08-04 EP claimed
EP-0685516-A1 Solid stabilizer composition with improved hydrolytic stability GENERAL ELECTRIC COMPANY (US) 1995-12-06 EP claimed
EP-0685516-B1 Solid stabilizer composition with improved hydrolytic stability GEN ELECTRIC (US) 1999-08-04 EP disclosed
EP-0685516-A1 Solid stabilizer composition with improved hydrolytic stability GENERAL ELECTRIC COMPANY (US) 1995-12-06 EP disclosed