SCHEMBL7519286

SCHEMBL7519286

CC(C)(Cl)[SiH](c1ccccc1)C(F)(F)F

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.32
ALDH1A1 P00352 1/20 0.32
HSD11B1 P28845 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
SCHEMBL3691011 0.71 MAPK1 (0.36) TSHRALDH1A1
SCHEMBL6835371 0.67 TSHR (0.38) TSHRALDH1A1
SCHEMBL1052821 0.66 ALDH1A1 (0.41) TSHRALDH1A1
SCHEMBL6571982 0.64 ALDH1A1 (0.52) TSHRALDH1A1
SCHEMBL27959345 0.64 MAPK1 (0.32) TSHRALDH1A1
SCHEMBL8374973 0.62 ALDH1A1 (0.33) TSHRALDH1A1
SCHEMBL705029 0.62 MAPK1 (0.33) TSHRALDH1A1
SCHEMBL10607277 0.62 TSHR (0.38) TSHRALDH1A1
SCHEMBL705415 0.62 MAPK1 (0.33) TSHRALDH1A1
SCHEMBL18398 0.61 MAPK1 (0.36) TSHRALDH1A1

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-0900225-B1 ALKYL-4-SILYL-PHENOLS AND ESTERS THEREOF AS ANTIATHEROSCLEROTIC AGENTS AVENTIS PHARMA INC (US) 2002-01-30 EP disclosed
US-5608095-A Alkyl-4-silyl-phenols and esters thereof as antiatherosclerotic agents HOECHST MARION ROUSSEL, INC. (US) 1997-03-04 US disclosed