SCHEMBL8557857

SCHEMBL8557857

Nc1ccncc1NS(=O)(=O)C(=O)C(F)(F)F

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ PTGS1 P23219 15/20 0.39
▸ KDM4E B2RXH2 2/20 0.39
▸ ALDH1A1 P00352 2/20 0.39
▸ GLA P06280 1/20 0.39
▸ GAA P10253 1/20 0.39
▸ PTGS2 P35354 14/20 0.38
▸ MEN1 O00255 1/20 0.36
▸ KDM6B O15054 1/20 0.36
▸ KDM4A O75164 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ THRB P10828 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ KDM4D Q6B0I6 1/20 0.36
▸ KDM4C Q9H3R0 1/20 0.36
▸ TDP1 Q9NUW8 1/20 0.36
▸ L3MBTL1 Q9Y468 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
SCHEMBL11594018 0.76 CA12 (0.40) PTGS1KDM4EALDH1A1GLAGAA
SCHEMBL18857498 0.76 GAA (0.42) PTGS1KDM4EALDH1A1GLAGAA
SCHEMBL8557169 0.73 HDAC1 (0.44) PTGS1ALDH1A1GAAPTGS2KDM4C
SCHEMBL18854020 0.70 CA12 (0.41) PTGS1KDM4EALDH1A1GLAGAA
SCHEMBL9256324 0.68 BRS3 (0.40) KDM4EALDH1A1GLAGAAMEN1
Toluene SCHEMBL28023301 0.68 PTGS1 (0.43) PTGS1PTGS2
SCHEMBL9017891 0.67 HDAC1 (0.49) KDM4EALDH1A1GLAGAAMEN1
SCHEMBL15432248 0.67 KDM4E (0.51) KDM4EALDH1A1GLAGAAMEN1
SCHEMBL31146203 0.66 KDM4E (0.47) KDM4EALDH1A1GLAGAAMEN1
SCHEMBL14357917 0.66 HDAC1 (0.46) KDM4EALDH1A1GLAGAAMEN1

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-0618209-B1 Pyridothiadiazines, processes for their preparation and pharmaceutical compositions containing them ADIR (FR) 1998-12-23 — — EP disclosed
EP-0618209-A1 Pyridothiadiazines, processes for their preparation and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 1994-10-05 — — EP disclosed
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