SCHEMBL8475216

SCHEMBL8475216

CCc1noc(-c2ccccc2C)c1-c1ccccc1S(N)(=O)=O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HEXA P06865 1/20 0.39
HEXB P07686 1/20 0.39
CA2 P00918 4/20 0.38
CA1 P00915 3/20 0.38
CA12 O43570 2/20 0.38
CA9 Q16790 2/20 0.38
BRD4 O60885 1/20 0.37
BRD2 P25440 1/20 0.37
BRD3 Q15059 1/20 0.37
SCN9A Q15858 1/20 0.35
MEN1 O00255 3/20 0.34
USP2 O75604 3/20 0.34
MAPT P10636 3/20 0.34
KMT2A Q03164 3/20 0.34
GAA P10253 2/20 0.34
THRB P10828 2/20 0.34
KDM4E B2RXH2 2/20 0.34
APAF1 O14727 2/20 0.34
ALDH1A1 P00352 2/20 0.34
CASP1 P29466 1/20 0.34

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
SCHEMBL8473764 0.86 ALOX5AP (0.37) CA2CA1CA12CA9MEN1
SCHEMBL8479645 0.86 PTGS2 (0.41) CA2CA1CA12CA9BRD4
SCHEMBL8481485 0.85 F10 (0.39) CA2CA1CA12CA9BRD4
SCHEMBL8479990 0.84 PTGS2 (0.40) HEXAHEXBCA2CA1CA12
SCHEMBL6170459 0.83 CA2 (0.55) CA2CA1CA12CA9LMNA
SCHEMBL8476610 0.83 F10 (0.39) HEXAHEXBCA2CA1CA12
SCHEMBL8478775 0.82 CHEK1 (0.39) HEXAHEXBCA2CA1BRD4
SCHEMBL8475639 0.82 BRD4 (0.41) CA2CA1BRD4BRD2BRD3
SCHEMBL8473985 0.82 PTGS2 (0.43) CA2CA9PTGS1PTGS2
SCHEMBL8481523 0.80 PTGS2 (0.41) CA2CA9PTGS1PTGS2

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-5859257-A ANTIINFLAMMATORY, ANTIARTHRITIC AGENTS G. D. SEARLE & CO. (US) 1999-01-12 US disclosed