SCHEMBL5587084

SCHEMBL5587084

CCCCc1c(O)c(O)c(CCCC)c2c1Oc1cc(Cl)c(Cl)c(Cl)c1O2

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AHR P35869 4/20 0.47
HPGD P15428 6/20 0.36
MAPK1 P28482 3/20 0.36
NPC1 O15118 2/20 0.36
HTT P42858 2/20 0.36
RAB9A P51151 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
CFTR P13569 4/20 0.33
SIRT1 Q96EB6 1/20 0.33
KDM4E B2RXH2 4/20 0.32
ALDH1A1 P00352 3/20 0.32
GLA P06280 3/20 0.32
GAA P10253 3/20 0.32
HSD17B10 Q99714 3/20 0.32
CASP7 P55210 2/20 0.32
KMT2A Q03164 2/20 0.32
CASP1 P29466 1/20 0.32
ATM Q13315 1/20 0.32
HIF1A Q16665 2/20 0.32
CYP1A1 P04798 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
SCHEMBL5588204 0.91 AHR (0.37) AHRHPGDMAPK1NPC1HTT
SCHEMBL5587352 0.91 AHR (0.50) AHRHPGDMAPK1NPC1HTT
SCHEMBL5590493 0.87 HPGD (0.37) AHRHPGDMAPK1NPC1HTT
SCHEMBL5588435 0.85 AHR (0.53) AHRHPGDMAPK1NPC1HTT
SCHEMBL5588156 0.83 AHR (0.45) AHRHPGDMAPK1NPC1HTT
SCHEMBL5588886 0.82 AHR (0.39) AHRHPGDMAPK1NPC1HTT
SCHEMBL5587977 0.81 AHR (0.41) AHRHPGDMAPK1NPC1HTT
SCHEMBL5588525 0.79 NPC1 (0.34) AHRHPGDMAPK1NPC1HTT
SCHEMBL5588883 0.79 AHR (0.38) AHRHPGDMAPK1NPC1HTT
SCHEMBL5588121 0.79 AHR (0.38) AHRHPGDMAPK1NPC1HTT

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 4 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
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 AHR 1434/4885HPGD 2689/4885MAPK1 2374/4885

“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.