SCHEMBL5587337

SCHEMBL5587337

COc1c(C)ccc(OC(=O)O)c1O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 3/20 0.46
MAPT P10636 3/20 0.46
PDE4A P27815 1/20 0.40
PDE4B Q07343 1/20 0.40
PDE4C Q08493 1/20 0.40
PDE4D Q08499 1/20 0.40
HPGD P15428 2/20 0.38
MEN1 O00255 1/20 0.38
POLB P06746 1/20 0.38
CYP3A4 P08684 1/20 0.38
GFER P55789 1/20 0.38
KMT2A Q03164 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
KDM4E B2RXH2 3/20 0.38
ALDH1A1 P00352 2/20 0.38
HSD17B10 Q99714 2/20 0.38
PTPN1 P18031 2/20 0.37
TSHR P16473 1/20 0.37
EPHX2 P34913 1/20 0.36
L3MBTL1 Q9Y468 2/20 0.36

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
SCHEMBL1590794 0.85 MAPT (0.62) TDP1MAPTKDM4EHSD17B10TSHR
SCHEMBL5587580 0.81 KDM4E (0.40) MAPTHPGDKDM4EALDH1A1HSD17B10
SCHEMBL12584714 0.81 MAPT (0.46) TDP1MAPTHPGDCYP3A4KDM4E
SCHEMBL30364533 0.81 MAPT (0.46) TDP1MAPTHPGDCYP3A4KDM4E
SCHEMBL5588933 0.79 NCEH1 (0.42) TDP1MAPTHPGDMEN1POLB
SCHEMBL5586778 0.79 TDP1 (0.44) TDP1MAPTPDE4APDE4BPDE4C
SCHEMBL5588864 0.79 PTPN1 (0.36) MAPTKMT2AKDM4EHSD17B10PTPN1
Acetic Acid SCHEMBL7565584 0.79 KDM4E (0.49) TDP1MAPTPDE4APDE4BPDE4C
SCHEMBL8022610 0.78 HTT (0.49) MAPTHPGDPOLBKMT2AKDM4E
SCHEMBL5588406 0.77 CYP3A4 (0.50) TDP1MAPTHPGDMEN1POLB

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 TDP1 3761/4885MAPT 585/4885PDE4A 4875/4885

“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.