SCHEMBL5676563

SCHEMBL5676563

CCCCCCc1c(CCC)cc(OC(=O)O)c(O)c1C

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 10/20 0.43
PPARA Q07869 4/20 0.40
PPARG P37231 3/20 0.40
PPARD Q03181 1/20 0.40
PTGS2 P35354 3/20 0.40
TYR P14679 1/20 0.39
PTPN1 P18031 1/20 0.38
TSHR P16473 1/20 0.38
BID P55957 1/20 0.36
BCL2L1 Q07817 1/20 0.36
MCL1 Q07820 1/20 0.36
BAK1 Q16611 1/20 0.36

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
SCHEMBL5678694 0.99 PPARG (0.41) ALOX5PPARAPPARGPPARDPTGS2
SCHEMBL5676068 0.93 PPARG (0.44) ALOX5PPARAPPARGPPARDPTGS2
SCHEMBL5677736 0.92 LDHA (0.39) PPARAPPARGPPARDPTPN1
SCHEMBL5678636 0.90 PPARG (0.39) ALOX5PPARAPPARGPPARDPTGS2
SCHEMBL5587372 0.90 PPARG (0.40) ALOX5PPARAPPARGPPARDPTGS2
SCHEMBL5676669 0.89 PPARG (0.43) ALOX5PPARAPPARGPPARDPTGS2
SCHEMBL5680786 0.88 ALOX5 (0.43) ALOX5PPARAPPARGPPARDPTGS2
SCHEMBL5920219 0.88 ALOX5 (0.43) ALOX5PPARAPPARGPPARDPTGS2
SCHEMBL5680669 0.87 PPARG (0.38) ALOX5PPARAPPARGPPARDPTGS2
SCHEMBL5919983 0.87 HMGCR (0.38) PPARAPPARGPPARDPTPN1

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 833/4885PPARA 3398/4885PPARG 3732/4885

“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.