SCHEMBL9519096

SCHEMBL9519096

O=C(NS(=O)(=O)c1cccc(Oc2ccc(F)cc2)c1)c1ccc(CO)nc1

nearest known ligand 0.53

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ BCL2L1 Q07817 8/20 0.53
▸ MCL1 Q07820 8/20 0.53
▸ PTGS2 P35354 4/20 0.44
▸ P4HTM Q9NXG6 4/20 0.44
▸ PTGS1 P23219 2/20 0.44
▸ EGFR P00533 1/20 0.40
▸ SCN9A Q15858 1/20 0.40
▸ PGR P06401 1/20 0.39

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
SCHEMBL9515728 0.93 P4HTM (0.45) BCL2L1MCL1PTGS2P4HTMPTGS1
SCHEMBL9517006 0.90 EGFR (0.50) BCL2L1MCL1PTGS2P4HTMPTGS1
SCHEMBL9516149 0.90 MCL1 (0.53) BCL2L1MCL1PTGS2P4HTMPTGS1
SCHEMBL9516981 0.90 BCL2L1 (0.60) BCL2L1MCL1PTGS2P4HTMPTGS1
SCHEMBL9517018 0.86 BCL2L1 (0.48) BCL2L1MCL1P4HTMEGFR
SCHEMBL9519730 0.84 MCL1 (0.62) BCL2L1MCL1P4HTMEGFR
SCHEMBL9516252 0.83 BCL2L1 (0.50) BCL2L1MCL1P4HTMEGFRPGR
SCHEMBL9517198 0.79 EGFR (0.62) BCL2L1MCL1PTGS2P4HTMPTGS1
SCHEMBL9517224 0.78 BCL2L1 (0.49) BCL2L1MCL1PTGS2P4HTMEGFR
SCHEMBL9515436 0.78 BCL2L1 (0.56) BCL2L1MCL1PTGS2P4HTMPTGS1

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
CN-1079466-A 4-or 5-(sulphur) acylimino-and (inferior sulphur) amidopyridine and pyridine-N-oxide thereof HOECHST AG (DE) 1993-12-15 — — CN disclosed
EP-0567997-A1 4- or 5-(sulf)imido- and (sulfon)amidopyridines and their pyridine-N-oxides, process for their preparation and their use as pharmaceutical HOECHST AKTIENGESELLSCHAFT (DE) 1993-11-03 — — EP disclosed
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