SCHEMBL9860765

SCHEMBL9860765

CC(C)(C)c1cc(I)ccc1O[Si](C)(C)C

nearest known ligand 0.32

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.32
TP53 P04637 1/20 0.32
CYP3A4 P08684 1/20 0.32
HPGD P15428 1/20 0.32
ALOX15 P16050 1/20 0.32
PTGDR2 Q9Y5Y4 1/20 0.31
ALDH1A1 P00352 1/20 0.30
GAA P10253 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
SCHEMBL7982954 0.79 ALDH1A1 (0.41) LMNATP53CYP3A4HPGDALOX15
SCHEMBL6479519 0.79 LMNA (0.47) LMNATP53CYP3A4HPGDALOX15
SCHEMBL9860880 0.78 PTGDR2 (0.51) LMNATP53CYP3A4HPGDALOX15
SCHEMBL3788910 0.75 KDM4E (0.30) ALOX15ALDH1A1
SCHEMBL15006511 0.72
SCHEMBL4762630 0.72 TDP1 (0.42) LMNATP53ALOX15ALDH1A1GAA
SCHEMBL15132134 0.71 ALDH1A1 (0.36) LMNAALOX15ALDH1A1
SCHEMBL22140210 0.69 ALDH1A1 (0.35) LMNAALOX15ALDH1A1
SCHEMBL21692815 0.67 CYP1A2 (0.35) LMNATP53CYP3A4ALOX15ALDH1A1
SCHEMBL13990327 0.67 ALDH1A1 (0.33) LMNAALOX15ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0251408-B1 NOVEL ANTI-INFLAMMATORY AGENTS, PHARMACEUTICAL COMPOSITIONS AND METHODS FOR REDUCING INFLAMMATION THE PROCTER & GAMBLE COMPANY (US) 1991-04-17 EP disclosed
EP-0251408-A1 Novel anti-inflammatory agents, pharmaceutical compositions and methods for reducing inflammation THE PROCTER & GAMBLE COMPANY (US) 1988-01-07 EP disclosed