SCHEMBL22010524

SCHEMBL22010524

COC(=O)C(Cc1ccccc1)CS(N)(=O)=N[Si](C)(C)C(C)(C)C

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 3/20 0.46
▸ MEN1 O00255 2/20 0.46
▸ POLB P06746 1/20 0.43
▸ CA9 Q16790 5/20 0.40
▸ CA2 P00918 4/20 0.40
▸ CA12 O43570 4/20 0.40
▸ CA1 P00915 2/20 0.40
▸ CA7 P43166 2/20 0.39
▸ CA14 Q9ULX7 2/20 0.39
▸ FOLH1 Q04609 1/20 0.38
▸ ATM Q13315 1/20 0.37
▸ MIF P14174 1/20 0.37
▸ ITGA4 P13612 1/20 0.36
▸ ITGB7 P26010 1/20 0.36

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
SCHEMBL25829683 0.82 KMT2A (0.52) KMT2AMEN1POLBCA9CA2
SCHEMBL21962922 0.79 KMT2A (0.57) KMT2AMEN1POLBCA9CA2
SCHEMBL22010526 0.79 POLB (0.44) KMT2AMEN1POLBCA9CA2
SCHEMBL22010522 0.78 POLB (0.39) KMT2AMEN1POLBCA9CA2
SCHEMBL25829889 0.77 MEN1 (0.43) KMT2AMEN1POLBCA9CA2
SCHEMBL7269972 0.76 POLB (0.48) KMT2AMEN1POLBCA9CA2
SCHEMBL21962937 0.75 KMT2A (0.51) KMT2AMEN1POLBCA9CA2
SCHEMBL7332197 0.73 KMT2A (0.50) KMT2AMEN1POLBCA9CA2
SCHEMBL7335528 0.73 KMT2A (0.50) KMT2AMEN1POLBCA9CA2
SCHEMBL7415092 0.72 KMT2A (0.52) KMT2AMEN1POLBCA9CA2

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
WO-2020102100-A9 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY NOVARTIS AG (CH) 2022-01-06 — — WO disclosed
WO-2020102100-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY NOVARTIS INFLAMMASOME RESEARCH, INC. (US) 2020-05-22 — — WO disclosed
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