SCHEMBL5587458

SCHEMBL5587458

CCCCc1ccc2c(c1CCCC)Oc1c(CCCC)c(O)c(O)c(CCCC)c1O2

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TYR P14679 3/20 0.40
CYP1A1 P04798 2/20 0.36
HTT P42858 2/20 0.34
HPGD P15428 2/20 0.34
ALOX5 P09917 2/20 0.34
NPC1 O15118 1/20 0.34
MAPK1 P28482 1/20 0.34
RAB9A P51151 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
MEN1 O00255 1/20 0.34
TP53 P04637 1/20 0.34
CYP3A4 P08684 1/20 0.34
MAPT P10636 1/20 0.34
ALOX15 P16050 1/20 0.34
TSHR P16473 1/20 0.34
KMT2A Q03164 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
CTRC Q99895 1/20 0.33
ELANE P08246 1/20 0.33
CTSG P08311 1/20 0.33

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
SCHEMBL5587741 0.95 TYR (0.45) TYRCYP1A1HTTALOX5MEN1
SCHEMBL5586955 0.94 TYR (0.48) TYRCYP1A1HTTALOX5MEN1
SCHEMBL5589834 0.94 TYR (0.48) TYRCYP1A1HTTALOX5MEN1
SCHEMBL5588988 0.94 TYR (0.48) TYRCYP1A1HTTALOX5MEN1
SCHEMBL5588455 0.94 TYR (0.48) TYRCYP1A1HTTALOX5MEN1
SCHEMBL5588512 0.88 PRKCI (0.35) ALOX5ELANECTSG
SCHEMBL5587995 0.84 CYP1A1 (0.40) TYRCYP1A1HPGDALOX5ELANE
SCHEMBL5588315 0.82 HTT (0.38) TYRCYP1A1HTTHPGDALOX5
SCHEMBL5590559 0.79 ALOX5 (0.46) TYRCYP1A1ALOX5PTGS2
SCHEMBL5586840 0.79 CYP1A1 (0.34) CYP1A1HTTHPGDNPC1MAPK1

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 TYR 1073/4885CYP1A1 1341/4885HTT 3594/4885

“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.