SCHEMBL6232359

SCHEMBL6232359

CCCc1c(OC)ccc(OC(=O)O)c1O

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.40
PPARG P37231 2/20 0.40
PPARD Q03181 2/20 0.40
PPARA Q07869 2/20 0.40
CYP1A2 P05177 2/20 0.40
LMNA P02545 1/20 0.40
CYP2C9 P11712 1/20 0.40
NFKB1 P19838 1/20 0.40
BLM P54132 1/20 0.40
GRM2 Q14416 1/20 0.40
TDP1 Q9NUW8 1/20 0.39
CYSLTR2 Q9NS75 6/20 0.39
CYSLTR1 Q9Y271 6/20 0.39
ALOX5 P09917 1/20 0.39
MEN1 O00255 1/20 0.38
TSHR P16473 1/20 0.38
KMT2A Q03164 1/20 0.38
HSD17B10 Q99714 1/20 0.38

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
SCHEMBL6234840 0.91 ALOX5 (0.47) PPARGPPARDPPARALMNAALOX5
SCHEMBL6233270 0.86 CYP1A2 (0.44) MAPTPPARGPPARDPPARACYP1A2
SCHEMBL6232138 0.84 CYP1A2 (0.49) MAPTPPARGPPARDPPARACYP1A2
SCHEMBL5588622 0.84 PRKCI (0.41) MAPTPPARGPPARDPPARACYP1A2
SCHEMBL5587875 0.84 LDHA (0.41) MAPTPPARGPPARDPPARACYP1A2
SCHEMBL5680670 0.84 CYP1A2 (0.40) MAPTPPARGPPARDPPARACYP1A2
SCHEMBL6229056 0.83 CYP1A2 (0.54) MAPTPPARGPPARDPPARACYP1A2
SCHEMBL6230820 0.83 CYP1A2 (0.36) MAPTPPARGPPARDPPARACYP1A2
SCHEMBL6232644 0.83 LMNA (0.36) MAPTPPARGPPARDPPARACYP1A2
SCHEMBL6233685 0.83 PPARG (0.37) MAPTPPARGPPARDPPARACYP1A2

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-1521758-A1 LATE TRANSITION METAL CATALYSTS FOR OLEFIN POLYMERIZATION AND OLIGOMERIZATION Exxonmobil Chemical Patents Inc. (US) 2005-04-13 EP disclosed
WO-2004007509-A1 LATE TRANSITION METAL CATALYSTS FOR OLEFIN POLYMERIZATION AND OLIGOMERIZATION EXXONMOBIL CHEMICAL PATENTS INC. (US) 2004-01-22 WO disclosed