SCHEMBL5587334

SCHEMBL5587334

COc1c(C)cc(O)c(O)c1C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.47
POLB P06746 3/20 0.47
KDM4E B2RXH2 2/20 0.47
GAA P10253 1/20 0.47
G6PD P11413 1/20 0.47
MAPK1 P28482 1/20 0.47
RECQL P46063 1/20 0.47
MCL1 Q07820 1/20 0.47
CYP3A4 P08684 3/20 0.46
PTGS2 P35354 1/20 0.46
KMT2A Q03164 2/20 0.46
MEN1 O00255 1/20 0.46
HPGD P15428 1/20 0.46
GFER P55789 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
ACHE P22303 1/20 0.44
IDO1 P14902 2/20 0.44
SLC37A4 O43826 1/20 0.44
TPMT P51580 4/20 0.43

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
SCHEMBL1590793 0.81 TPMT (0.56) MAPTPOLBKDM4ECYP3A4PTGS2
SCHEMBL5587577 0.81 CYP3A4 (0.42) MAPTPOLBKDM4EGAAG6PD
SCHEMBL14124067 0.80 GLRA3 (0.61) MAPTPOLBKDM4EGAAG6PD
SCHEMBL5586775 0.79 PTGS2 (0.43) MAPTPOLBKDM4ECYP3A4PTGS2
SCHEMBL5588860 0.78 LDHA (0.43) MAPTPOLBKDM4EGAAG6PD
SCHEMBL14760848 0.78 MAPT (0.53) MAPTPOLBKDM4EGAAG6PD
SCHEMBL30805785 0.78 KMT2A (0.43) MAPTPOLBKDM4EGAAG6PD
SCHEMBL27302869 0.78 KMT2A (0.43) MAPTPOLBKDM4EGAAG6PD
SCHEMBL5588929 0.76 CYP3A4 (0.52) MAPTPOLBKDM4EGAAG6PD
SCHEMBL5590420 0.76 THRA (0.46) PLA2G2A

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-7247687-B2 Late transition metal catalysts for olefin polymerization and oligomerization EXXONMOBIL CHEMICAL PATENTS INC. (US) 2007-07-24 US disclosed
EP-1521758-B1 LATE TRANSITION METAL CATALYSTS FOR OLEFIN POLYMERIZATION AND OLIGOMERIZATION EXXONMOBIL CHEM PATENTS INC (US) 2006-05-24 EP disclosed
US-20060047094-A1 Late transition metal catalysts for olefin polymerization and oligomerization EXXONMOBIL CHEMICAL PATENTS INC. 2006-03-02 US disclosed
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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20060047094-A1 Late transition metal catalysts for olefin polymerization and oligomerization MLX, LOX, LMTK3 MAPT 585/4885POLB 1104/4885KDM4E 1868/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.