SCHEMBL5590702

SCHEMBL5590702

CCCc1c(O)c(O)c(C(=O)O)c(C2CCCCC2)c1CC

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LDHA P00338 3/20 0.43
LDHB P07195 3/20 0.43
CNR1 P21554 6/20 0.32
CNR2 P34972 5/20 0.32
DAGLA Q9Y4D2 1/20 0.32
PTPN1 P18031 1/20 0.31
PTPN11 Q06124 1/20 0.31
EPHX2 P34913 1/20 0.30
ABCB11 O95342 1/20 0.30
ACMSD Q8TDX5 1/20 0.30

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
SCHEMBL5588974 0.94 LDHA (0.44) LDHALDHBCNR1CNR2DAGLA
SCHEMBL5587266 0.92 LDHA (0.38) LDHALDHBCNR1CNR2DAGLA
SCHEMBL5586964 0.91 LDHA (0.34) LDHALDHBCNR1CNR2ACMSD
SCHEMBL5588260 0.89 LDHA (0.44) LDHALDHBCNR1CNR2DAGLA
SCHEMBL5587695 0.86 LDHA (0.40) LDHALDHBCNR1CNR2DAGLA
SCHEMBL5589864 0.86 LDHA (0.46) LDHALDHBCNR1CNR2DAGLA
SCHEMBL5587330 0.84 LDHA (0.36) LDHALDHBCNR1CNR2ACMSD
SCHEMBL5590693 0.80 LDHA (0.39) LDHALDHBCNR1CNR2DAGLA
SCHEMBL17323558 0.79 KMO (0.33) CNR1CNR2ACMSD
SCHEMBL5589164 0.76 CNR1 (0.38) CNR1CNR2EPHX2

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 486/4885CNR1 3323/4885

“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.