SCHEMBL5590484

SCHEMBL5590484

CCOc1c(C)c(C)c(O)c(O)c1C(=O)O

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LDHA P00338 5/20 0.41
LDHB P07195 5/20 0.41
ALDH1A1 P00352 2/20 0.40
KDM4E B2RXH2 2/20 0.40
HPGD P15428 1/20 0.40
HSD17B10 Q99714 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
APP P05067 1/20 0.35
BACE1 P56817 1/20 0.35
THRB P10828 1/20 0.34
IMPDH2 P12268 1/20 0.34
USP2 O75604 1/20 0.33
PSMG3 Q9BT73 1/20 0.33
TSHR P16473 1/20 0.33
METAP2 P50579 1/20 0.32
MAPT P10636 1/20 0.32

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
SCHEMBL5587784 0.86 LDHA (0.39) LDHALDHBALDH1A1L3MBTL1TSHR
SCHEMBL5588911 0.82 PSEN1 (0.44) LDHALDHBTHRBTSHR
SCHEMBL5590742 0.81 APP (0.41) LDHALDHBALDH1A1KDM4EHPGD
SCHEMBL5590630 0.81 THRB (0.36) LDHALDHBALDH1A1KDM4EHPGD
SCHEMBL5588890 0.80 PSEN1 (0.46) THRBTSHR
SCHEMBL5590430 0.80 PSEN1 (0.46) THRBTSHR
SCHEMBL5588934 0.80 PSEN1 (0.46) THRBTSHR
SCHEMBL5587139 0.80 PSEN1 (0.46) THRBTSHR
SCHEMBL5590565 0.79 THRB (0.37) ALDH1A1KDM4EHPGDHSD17B10L3MBTL1
SCHEMBL5588402 0.79 PSMG3 (0.48) LDHALDHBALDH1A1KDM4EHPGD

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 LDHA 320/4885LDHB 486/4885ALDH1A1 2181/4885

“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.