SCHEMBL5680701

SCHEMBL5680701

CCCCc1cc(OC(=O)O)c(O)c(CCCC)c1C

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PPARG P37231 1/20 0.40
PPARD Q03181 1/20 0.40
PPARA Q07869 1/20 0.40
ALOX5 P09917 9/20 0.39
NPC1 O15118 1/20 0.37
HPGD P15428 1/20 0.37
MAPK1 P28482 1/20 0.37
HTT P42858 1/20 0.37
RAB9A P51151 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
PTGS2 P35354 3/20 0.36
TYR P14679 2/20 0.36
PTGES O14684 1/20 0.35
TOP2A P11388 1/20 0.35
KDM4E B2RXH2 2/20 0.35
PTPN1 P18031 1/20 0.35
ALDH1A1 P00352 1/20 0.35
HSD17B10 Q99714 1/20 0.35
PKM P14618 1/20 0.35

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
SCHEMBL5678607 0.96 ALOX5 (0.38) PPARGPPARDPPARAALOX5NPC1
SCHEMBL5678342 0.94 ALOX5 (0.39) PPARGPPARDPPARAALOX5NPC1
SCHEMBL5678455 0.93 PPARG (0.43) PPARGPPARDPPARAALOX5PTGS2
SCHEMBL5677643 0.92 PPARG (0.44) PPARGPPARDPPARAALOX5PTGS2
SCHEMBL5920219 0.92 ALOX5 (0.43) PPARGPPARDPPARAALOX5PTGS2
SCHEMBL5678309 0.90 ALOX5 (0.44) PPARGPPARDPPARAALOX5PTGS2
SCHEMBL5920741 0.90 LDHA (0.39) PPARGPPARDPPARAALOX5PTPN1
SCHEMBL5587372 0.88 PPARG (0.40) PPARGPPARDPPARAALOX5NPC1
SCHEMBL5681097 0.87 ALOX5 (0.44) PPARGPPARDPPARAALOX5PTGS2
SCHEMBL5588358 0.87 PPARG (0.39) PPARGPPARDPPARAALOX5NPC1

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 PPARG 3732/4885PPARD 4015/4885PPARA 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.