SCHEMBL9743151

SCHEMBL9743151

C[Si](C)(C)c1cc(S(=O)(=O)c2ccc(C(=O)O)c([Si](C)(C)C)c2)ccc1C(=O)O

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
APEX1 P27695 3/20 0.45
POLB P06746 2/20 0.45
CTDSP1 Q9GZU7 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
KDM4E B2RXH2 2/20 0.42
LMNA P02545 1/20 0.41
ALDH1A1 P00352 3/20 0.39
HPGD P15428 1/20 0.39
HSD17B10 Q99714 1/20 0.39
SLC16A1 P53985 1/20 0.37
ACLY P53396 2/20 0.36
CYP1A2 P05177 1/20 0.35
GAA P10253 1/20 0.35
MAPT P10636 1/20 0.35
TSHR P16473 1/20 0.35
MAPK1 P28482 1/20 0.35

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
SCHEMBL9744286 0.77 ACMSD (0.46) KDM4EACLYCYP1A2
SCHEMBL1397921 0.77 APEX1 (0.67) APEX1POLBCTDSP1L3MBTL1KDM4E
SCHEMBL29364883 0.77 APEX1 (0.67) APEX1POLBCTDSP1L3MBTL1KDM4E
SCHEMBL29394064 0.77 APEX1 (0.67) APEX1POLBCTDSP1L3MBTL1KDM4E
SCHEMBL65212 0.77 APEX1 (0.67) APEX1POLBCTDSP1L3MBTL1KDM4E
SCHEMBL2807317 0.76 APEX1 (0.53) APEX1POLBCTDSP1L3MBTL1KDM4E
SCHEMBL9743140 0.76 ALDH1A1 (0.32) KDM4ELMNAALDH1A1GAAMAPT
SCHEMBL5834234 0.76 MYC (0.47) POLBL3MBTL1KDM4EALDH1A1HPGD
SCHEMBL268999 0.75 APEX1 (0.65) APEX1POLBCTDSP1L3MBTL1KDM4E
SCHEMBL8999902 0.75 APEX1 (0.70) APEX1POLBCTDSP1L3MBTL1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5082959-A Oxidation of alkyl groups substituted on a trialkylsilyl-substituted aromatic ring using oxygen gas and a cobalt and/or manganese compound and a bromide as catalyts AMOCO CORPORATION (US) 1992-01-21 US disclosed