SCHEMBL9868446

SCHEMBL9868446

CCO/C(C)=N\S(=O)(=O)c1nc(-c2ccccc2)ns1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.49
L3MBTL1 Q9Y468 2/20 0.49
SMN1; SMN2 Q16637 7/20 0.42
RAB9A P51151 6/20 0.42
NPC1 O15118 5/20 0.42
HTT P42858 1/20 0.42
LMNA P02545 6/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
TP53 P04637 3/20 0.38
TSHR P16473 2/20 0.38
KDM4E B2RXH2 2/20 0.38
MAPT P10636 2/20 0.38
ADORA3 P0DMS8 2/20 0.38
MAPK1 P28482 1/20 0.38
ATM Q13315 1/20 0.38
HSD17B10 Q99714 1/20 0.38
RXFP1 Q9HBX9 1/20 0.38
POLB P06746 1/20 0.37
NFKB1 P19838 1/20 0.37

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
SCHEMBL9868449 1.00 ALDH1A1 (0.49) ALDH1A1L3MBTL1SMN1; SMN2RAB9ANPC1
SCHEMBL9867384 0.87 MAPT (0.52) ALDH1A1L3MBTL1SMN1; SMN2RAB9ANPC1
SCHEMBL9867392 0.87 MAPT (0.52) ALDH1A1L3MBTL1SMN1; SMN2RAB9ANPC1
SCHEMBL9867544 0.86 ALDH1A1 (0.48) ALDH1A1L3MBTL1SMN1; SMN2RAB9ANPC1
SCHEMBL9867549 0.86 ALDH1A1 (0.48) ALDH1A1L3MBTL1SMN1; SMN2RAB9ANPC1
SCHEMBL9867147 0.85 CYP19A1 (0.42) ALDH1A1SMN1; SMN2RAB9ANPC1TP53
SCHEMBL9867152 0.85 CYP19A1 (0.42) ALDH1A1SMN1; SMN2RAB9ANPC1TP53
SCHEMBL9867023 0.85 NPC1 (0.41) ALDH1A1L3MBTL1SMN1; SMN2RAB9ANPC1
SCHEMBL9867029 0.85 NPC1 (0.41) ALDH1A1L3MBTL1SMN1; SMN2RAB9ANPC1
SCHEMBL9867538 0.78 SMN1; SMN2 (0.45) ALDH1A1L3MBTL1SMN1; SMN2RAB9ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4758578-A Arylthiadiazolylsulfonamides, pharmaceutical compositions and use HOECHST ROUSSEL PHARMACEUTICALS, INC. (US) 1988-07-19 US claimed
US-4985450-A TREATMENT OF GLAUCOMA AVENTIS PHARMACEUTICALS INC. 1991-01-15 US disclosed
US-4873239-A GLAUCOMA TREATMENT HOECHST-ROUSSEL PHARMACEUTICALS, INC. (US) 1989-10-10 US disclosed
EP-0276822-A1 Arylthiadiazolylsulfonamides and derivatives, a process for their preparation and their use as medicaments HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1988-08-03 EP disclosed
US-4758578-A Arylthiadiazolylsulfonamides, pharmaceutical compositions and use HOECHST ROUSSEL PHARMACEUTICALS, INC. (US) 1988-07-19 US disclosed