SCHEMBL5590336

SCHEMBL5590336

CCCCOc1cc(CCCC)c(O)c(O)c1CCCC

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 10/20 0.44
PTGS2 P35354 4/20 0.43
NPC1 O15118 1/20 0.41
HPGD P15428 1/20 0.41
MAPK1 P28482 1/20 0.41
HTT P42858 1/20 0.41
RAB9A P51151 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
TYR P14679 1/20 0.39
ESR1 P03372 2/20 0.38
MAOA P21397 1/20 0.37

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
SCHEMBL5589928 0.95 ALOX5 (0.43) ALOX5PTGS2NPC1HPGDMAPK1
SCHEMBL5588563 0.90 ALOX5 (0.44) ALOX5PTGS2NPC1HPGDMAPK1
SCHEMBL5587924 0.87 ALOX5 (0.42) ALOX5PTGS2NPC1HPGDMAPK1
SCHEMBL5590186 0.85 ALOX5 (0.57) ALOX5PTGS2NPC1HPGDMAPK1
SCHEMBL5590341 0.80 CYSLTR2 (0.38) ALOX5ESR1
SCHEMBL298016 0.79 CYP1A2 (0.37) NPC1HPGDMAPK1HTTRAB9A
SCHEMBL14354685 0.78 CYP1A2 (0.44) ALOX5NPC1MAPK1HTTNPSR1
SCHEMBL5587271 0.76 GABRA1 (0.36) ALOX5NPC1HTTRAB9AESR1
SCHEMBL5589930 0.76 ALOX5 (0.37) ALOX5
SCHEMBL25328760 0.75 ESR1 (0.40) ALOX5HPGDTYRESR1

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 3 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

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 ALOX5 188/4885PTGS2 3242/4885NPC1 3851/4885

“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.