SCHEMBL5680717

SCHEMBL5680717

CCCCCc1cc(CCCCC)c(CCCCC)c(O)c1O

nearest known ligand 0.52

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 11/20 0.50
PTGS2 P35354 7/20 0.49
TYR P14679 2/20 0.49
CYP3A4 P08684 2/20 0.46
HTT P42858 2/20 0.46
MEN1 O00255 1/20 0.46
TP53 P04637 1/20 0.46
MAPT P10636 1/20 0.46
ALOX15 P16050 1/20 0.46
TSHR P16473 1/20 0.46
KMT2A Q03164 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
NPC1 O15118 1/20 0.42
HPGD P15428 1/20 0.42
MAPK1 P28482 1/20 0.42
RAB9A P51151 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
CYP19A1 P11511 1/20 0.42

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
SCHEMBL5678560 0.98 ALOX5 (0.49) ALOX5PTGS2TYRCYP3A4HTT
SCHEMBL5677890 0.98 ALOX5 (0.49) ALOX5PTGS2TYRCYP3A4HTT
SCHEMBL5920562 0.98 ALOX5 (0.49) ALOX5PTGS2TYRCYP3A4HTT
SCHEMBL5677022 0.96 ALOX5 (0.47) ALOX5PTGS2TYRCYP3A4HTT
SCHEMBL5680724 0.94 ALOX5 (0.46) ALOX5PTGS2TYRCYP3A4HTT
SCHEMBL5848803 0.94 ALOX5 (0.45) ALOX5PTGS2TYRCYP3A4HTT
SCHEMBL5676188 0.92 TYR (0.46) ALOX5PTGS2TYRCYP3A4HTT
SCHEMBL5921122 0.92 ALOX5 (0.47) ALOX5PTGS2TYRCYP3A4HTT
SCHEMBL5678602 0.92 ALOX5 (0.47) ALOX5PTGS2TYRCYP3A4HTT
SCHEMBL5676141 0.92 ALOX5 (0.47) ALOX5PTGS2TYRCYP3A4HTT

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-20060036049-A1 Soluble late transition metal catalysts for olefin oligomerizations III ZHAO BAIYI 2006-02-16 US disclosed
EP-1620447-A1 SOLUBLE LATE TRANSITION METAL CATALYSTS FOR OLEFIN OLIGOMERIZATIONS III Exxonmobil Chemical Patents Inc. (US) 2006-02-01 EP disclosed
WO-2003102006-A1 SOLUBLE LATE TRANSITION METAL CATALYSTS FOR OLEFIN OLIGOMERIZATIONS III EXXONMOBIL CHEMICAL PATENTS INC. (US) 2003-12-11 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-20060036049-A1 Soluble late transition metal catalysts for olefin oligomerizations III COMT, CD69, SPR ALOX5 833/4885PTGS2 1827/4885TYR 275/4885

“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.