SCHEMBL5676396

SCHEMBL5676396

CCCCCc1c(CCC)ccc(OC(=O)O)c1O

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 3/20 0.41
TYR P14679 1/20 0.41
PPARA Q07869 2/20 0.39
PPARG P37231 1/20 0.39
TSHR P16473 1/20 0.39
PTGS2 P35354 1/20 0.39
PRKCI P41743 1/20 0.38
BID P55957 2/20 0.38
BCL2L1 Q07817 2/20 0.38
MCL1 Q07820 2/20 0.38
BAK1 Q16611 2/20 0.38
LTB4R Q15722 1/20 0.38
LTB4R2 Q9NPC1 1/20 0.38

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
SCHEMBL5588176 0.96 TYR (0.45) ALOX5TYRPPARAPPARGTSHR
SCHEMBL5676413 0.96 PRKCI (0.39) ALOX5TYRPPARAPPARGTSHR
SCHEMBL5677027 0.94 ALOX5 (0.42) ALOX5TYRPPARAPPARGTSHR
SCHEMBL5589532 0.94 TYR (0.48) ALOX5TYRPPARAPPARGTSHR
SCHEMBL5677872 0.94 TYR (0.44) ALOX5TYRPPARAPPARGTSHR
SCHEMBL5588746 0.94 TYR (0.48) ALOX5TYRPPARAPPARGTSHR
SCHEMBL5590459 0.94 TYR (0.48) ALOX5TYRPPARAPPARGTSHR
SCHEMBL5586630 0.94 TYR (0.48) ALOX5TYRPPARAPPARGTSHR
SCHEMBL5589011 0.94 TYR (0.48) ALOX5TYRPPARAPPARGTSHR
SCHEMBL5195274 0.94 TYR (0.44) ALOX5TYRPPARAPPARGTSHR

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 833/4885TYR 275/4885PPARA 3398/4885

“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.