SCHEMBL5680252

SCHEMBL5680252

CC[Si](CC)(CC)Cc1cc(C)c(O)c(OC(=O)O)c1

nearest known ligand 0.37

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HMGB1 P09429 1/20 0.37
CXCL12 P48061 1/20 0.37
PKM P14618 1/20 0.34
ESR1 P03372 2/20 0.31

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
SCHEMBL5680795 0.83 HMGB1 (0.42) HMGB1CXCL12PKMESR1
SCHEMBL5676532 0.80 HMGB1 (0.40) HMGB1CXCL12ESR1
SCHEMBL5676539 0.78 HPGD (0.45) HMGB1CXCL12PKMESR1
SCHEMBL5920689 0.77 KDM4E (0.30)
SCHEMBL5676807 0.77 PTGS2 (0.45) ESR1
SCHEMBL5680824 0.73 NPSR1 (0.31)
SCHEMBL5588261 0.72 ALDH1A1 (0.42) HMGB1CXCL12PKM
SCHEMBL5676821 0.70 ALOX5 (0.35) PKM
SCHEMBL5677861 0.70 LDHA (0.33) HMGB1CXCL12PKMESR1
SCHEMBL5590189 0.70 CYP3A4 (0.38) HMGB1CXCL12ESR1

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 HMGB1 696/4885CXCL12 3559/4885PKM 3434/4885

“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.