SCHEMBL5587870

SCHEMBL5587870

CCCc1c(C)cc(O)c(O)c1C(=O)O

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LDHA P00338 4/20 0.58
LDHB P07195 4/20 0.58
PTPN1 P18031 5/20 0.47
PTPN11 Q06124 3/20 0.47
CYP3A4 P08684 2/20 0.44
MAPT P10636 1/20 0.44
ACHE P22303 1/20 0.42
JUN P05412 1/20 0.41
PTPN2 P17706 2/20 0.38
APP P05067 1/20 0.38
BACE1 P56817 1/20 0.38
DRD2 P14416 1/20 0.37
PRKCI P41743 1/20 0.37
HCAR2 Q8TDS4 1/20 0.37
ABCB11 O95342 1/20 0.36
SLC37A4 O43826 1/20 0.36
MCL1 Q07820 2/20 0.36
BID P55957 1/20 0.36
BCL2L1 Q07817 1/20 0.36
BAK1 Q16611 1/20 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
SCHEMBL5678439 0.92 LDHA (0.49) LDHALDHBPTPN1PTPN11CYP3A4
SCHEMBL5678446 0.90 KAT8 (0.48) LDHALDHBPTPN1MCL1BID
SCHEMBL5680835 0.86 CYP3A4 (0.46) LDHALDHBPTPN1PTPN11CYP3A4
SCHEMBL10722732 0.83 LDHA (0.58) LDHALDHBPTPN1PTPN11CYP3A4
SCHEMBL5588619 0.83 PTPN1 (0.56) LDHALDHBPTPN1PTPN11JUN
SCHEMBL5678230 0.83 PTPN1 (0.51) LDHALDHBPTPN1PTPN11JUN
SCHEMBL5676358 0.79 PTPN1 (0.51) LDHALDHBPTPN1PTPN11PTPN2
SCHEMBL5590248 0.79 PTPN1 (0.47) LDHALDHBPTPN1PTPN11MAPT
SCHEMBL5676847 0.78 PTPN1 (0.54) LDHALDHBPTPN1PTPN11PTPN2
SCHEMBL5680885 0.78 BID (0.52) LDHALDHBPTPN1PTPN11MAPT

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 8 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
US-20060036049-A1 Soluble late transition metal catalysts for olefin oligomerizations III ZHAO BAIYI 2006-02-16 US disclosed
EP-1620447-A1 SOLUBLE LATE TRANSITION METAL CATALYSTS FOR OLEFIN OLIGOMERIZATIONS III Exxonmobil Chemical Patents Inc. (US) 2006-02-01 EP 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
WO-2003102006-A1 SOLUBLE LATE TRANSITION METAL CATALYSTS FOR OLEFIN OLIGOMERIZATIONS III EXXONMOBIL CHEMICAL PATENTS INC. (US) 2003-12-11 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 (2 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-20060036049-A1 Soluble late transition metal catalysts for olefin oligomerizations III COMT, CD69, SPR LDHA 3482/4885LDHB 3990/4885PTPN1 4673/4885
US-20060047094-A1 Late transition metal catalysts for olefin polymerization and oligomerization MLX, LOX, LMTK3 LDHA 320/4885LDHB 486/4885PTPN1 4679/4885

“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.