SCHEMBL3820152

SCHEMBL3820152

CC(C)(C)c1cc(Sc2cc(C(C)(C)C)cc(C(C)(C)C)c2O[Si](C)(C)C)c(O[Si](C)(C)C)c(C(C)(C)C)c1

nearest known ligand 0.33

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.33
TP53 P04637 1/20 0.33
CYP3A4 P08684 1/20 0.33
ALOX15 P16050 1/20 0.33
TSHR P16473 1/20 0.33
MAPK1 P28482 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
HIF1A Q16665 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
GABBR2 O75899 1/20 0.31
GABBR1 Q9UBS5 1/20 0.31
RARG P13631 1/20 0.31
RXRA P19793 1/20 0.31
PPARG P37231 1/20 0.31
HSP90AA1 P07900 1/20 0.30

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
SCHEMBL3819722 0.91 HSP90AA1 (0.38) ALDH1A1TP53CYP3A4ALOX15TSHR
SCHEMBL3819955 0.83 SMN1; SMN2 (0.38) ALDH1A1TP53CYP3A4ALOX15TSHR
SCHEMBL5086473 0.77 CYP1A2 (0.33) ALDH1A1CYP3A4ALOX15TSHRHIF1A
SCHEMBL3822369 0.76 RXRA (0.44) ALDH1A1TP53CYP3A4ALOX15TSHR
SCHEMBL3824912 0.75 SMN1; SMN2 (0.47) ALDH1A1TP53CYP3A4ALOX15TSHR
SCHEMBL5085779 0.75 GABBR2 (0.31) GABBR2GABBR1
SCHEMBL3819726 0.74 HSP90AA1 (0.40) ALDH1A1TP53CYP3A4ALOX15TSHR
SCHEMBL7949227 0.72 SMN1; SMN2 (0.38) ALDH1A1CYP3A4SMN1; SMN2HIF1A
SCHEMBL3825984 0.72 CA2 (0.43) ALDH1A1TP53CYP3A4ALOX15TSHR
SCHEMBL9327674 0.72 ALDH1A1 (0.33) ALDH1A1TP53CYP3A4ALOX15TSHR

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1406726-B1 ORGANOALUMINIUM CATALYST, ITS PREPARATION AND ITS USE IN A PROCESS FOR THE POLYMERIZATION OF ALKYLENE OXIDES UNION CARBIDE CHEM PLASTIC (US) 2009-08-26 EP disclosed
US-7456127-B2 Organoaluminum catalyst UNION CARBIDE CHEMICALS AND PLASTICS TECHNOLOGY CORPORATION 2008-11-25 US disclosed
US-20040142814-A1 Organoaluminum catalyst UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY LLC 2004-07-22 US disclosed
EP-1406726-A2 ORGANOALUMINIUM CATALYST, ITS PREPARATION AND ITS USE IN A PROCESS FOR THE POLYMERIZATION OF ALKYLENE OXIDES UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (US) 2004-04-14 EP disclosed
WO-2002098559-A2 ORGANOALUMINUM CATALYST, ITS PREPARATION AND ITS USE IN A PROCESS FOR THE POLYMERIZATION OF ALKYLENE OXIDES UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY COR PORATION (US) 2002-12-12 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-20040142814-A1 Organoaluminum catalyst AHR, LBR, NR1H3 ALDH1A1 1949/4885TP53 2865/4885CYP3A4 247/4885

“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.