SCHEMBL6234048

SCHEMBL6234048

COc1cc(O)c(O)c(C(C)(C)C)c1OC

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 2/20 0.47
MAPT P10636 2/20 0.47
ALOX5 P09917 4/20 0.45
LMNA P02545 1/20 0.44
TP53 P04637 1/20 0.44
HPGD P15428 1/20 0.44
ALOX15 P16050 1/20 0.44
TPMT P51580 1/20 0.41
PTGS2 P35354 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
ACHE P22303 1/20 0.39
TUBB1 Q9H4B7 4/20 0.39
TUBB4A P04350 3/20 0.39
TUBB P07437 3/20 0.39
TUBA3C P0DPH7 3/20 0.39
TUBA1B P68363 3/20 0.39
TUBA4A P68366 3/20 0.39
TUBB4B P68371 3/20 0.39
TUBB3 Q13509 3/20 0.39
TUBB2A Q13885 3/20 0.39

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
SCHEMBL11881848 0.77 MAPT (0.56) CYP3A4MAPTALOX5TPMTPTGS2
SCHEMBL5587869 0.77 MAPT (0.56) CYP3A4MAPTALOX5LMNATP53
SCHEMBL6234052 0.76 TPMT (0.41) CYP3A4MAPTLMNATP53HPGD
SCHEMBL14788891 0.76 TP53 (0.47) CYP3A4MAPTALOX5LMNATP53
SCHEMBL11240257 0.74 CYP3A4 (0.42) CYP3A4MAPTALOX5LMNATP53
SCHEMBL5589207 0.74 CA1 (0.39) CYP3A4MAPTLMNATP53HPGD
SCHEMBL784922 0.73 CYP3A4 (0.44) CYP3A4MAPTALOX5LMNATP53
SCHEMBL785019 0.73 FASN (0.45) CYP3A4MAPTALOX5LMNATP53
SCHEMBL6252167 0.73 TSHR (0.41) LMNAPTGS2TUBB1GAA
SCHEMBL1054064 0.72 HIF1A (0.50) CYP3A4MAPTLMNATP53HPGD

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 4 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 claimed
WO-2004007509-A1 LATE TRANSITION METAL CATALYSTS FOR OLEFIN POLYMERIZATION AND OLIGOMERIZATION EXXONMOBIL CHEMICAL PATENTS INC. (US) 2004-01-22 WO claimed
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