SCHEMBL5589845

SCHEMBL5589845

CCCCCc1c(O)c(O)c(Br)c(Br)c1Br

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 3/20 0.43
CA2 P00918 3/20 0.43
CA4 P22748 2/20 0.43
CA6 P23280 2/20 0.43
PTPN1 P18031 1/20 0.43
DRD4 P21917 2/20 0.41
MAOA P21397 1/20 0.39
DRD3 P35462 1/20 0.39
ALOX5 P09917 5/20 0.39
TYR P14679 1/20 0.38
PTGS2 P35354 3/20 0.36
CYP3A4 P08684 2/20 0.36
ALDH1A1 P00352 2/20 0.36
HPGD P15428 2/20 0.36
MAPK1 P28482 2/20 0.36
HIF1A Q16665 2/20 0.36
HSD17B10 Q99714 2/20 0.36
ALOX15 P16050 1/20 0.36
RECQL P46063 1/20 0.36
CYP19A1 P11511 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
SCHEMBL5588915 0.98 CA1 (0.41) CA1CA2CA4CA6PTPN1
SCHEMBL5590423 0.98 CA1 (0.41) CA1CA2CA4CA6PTPN1
SCHEMBL5590580 0.98 CA1 (0.41) CA1CA2CA4CA6PTPN1
SCHEMBL5588788 0.98 CA1 (0.41) CA1CA2CA4CA6PTPN1
SCHEMBL5589374 0.98 CA1 (0.41) CA1CA2CA4CA6PTPN1
SCHEMBL5587042 0.94 CA1 (0.44) CA1CA2CA4CA6PTPN1
SCHEMBL5587877 0.92 CA1 (0.43) CA1CA2CA4CA6PTPN1
SCHEMBL5589883 0.90 CA1 (0.41) CA1CA2CA4CA6PTPN1
SCHEMBL5587012 0.90 CA1 (0.41) CA1CA2CA4CA6PTPN1
SCHEMBL5588496 0.90 CA1 (0.41) CA1CA2CA4CA6PTPN1

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 CA1 3572/4885CA2 2455/4885CA4 2135/4885

“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.