SCHEMBL5676924

SCHEMBL5676924

CCCCCCCCNc1cccc(OC(=O)O)c1O

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ NAAA Q02083 1/20 0.41
▸ CNR2 P34972 3/20 0.41
▸ CNR1 P21554 1/20 0.41
▸ CHRM2 P08172 1/20 0.40
▸ PPARG P37231 1/20 0.40
▸ PPARA Q07869 1/20 0.40
▸ ZDHHC2 Q9UIJ5 1/20 0.40
▸ EPHX1 P07099 3/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ HTT P42858 1/20 0.40

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
SCHEMBL28922400 0.85 CNR2 (0.41) L3MBTL1NAAACNR2CNR1CHRM2
SCHEMBL5920724 0.81 HCAR3 (0.42) NAAACNR2CNR1ZDHHC2
SCHEMBL15668447 0.79 PLK1 (0.51) NAAACNR2CNR1ALDH1A1
SCHEMBL7603848 0.77 CNR2 (0.50) NAAACNR2CNR1ALDH1A1
SCHEMBL5589212 0.77 MEN1 (0.52) CNR2CNR1CHRM2PPARGPPARA
SCHEMBL5589411 0.77 MEN1 (0.52) CNR2CNR1CHRM2PPARGPPARA
SCHEMBL5587935 0.77 MEN1 (0.52) CNR2CNR1CHRM2PPARGPPARA
SCHEMBL5589313 0.77 MEN1 (0.52) CNR2CNR1CHRM2PPARGPPARA
SCHEMBL5587075 0.77 MEN1 (0.52) CNR2CNR1CHRM2PPARGPPARA
SCHEMBL5589830 0.77 MEN1 (0.52) CNR2CNR1CHRM2PPARGPPARA

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 L3MBTL1 1451/4885NAAA 1064/4885CNR2 4148/4885

“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.

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