SCHEMBL9867461

SCHEMBL9867461

CO/C(=N\S(=O)(=O)c1nc(-c2ccccc2C)ns1)C(C)C

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.36
LMNA P02545 3/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
MAPT P10636 2/20 0.34
ALDH1A1 P00352 2/20 0.33
SLC9A1 P19634 1/20 0.33
TP53 P04637 2/20 0.31
ADORA3 P0DMS8 1/20 0.31
IDO1 P14902 1/20 0.31
CYP1A2 P05177 2/20 0.31
CYP2C19 P33261 2/20 0.31
ALOX15 P16050 1/20 0.31
HIF1A Q16665 1/20 0.31
HSD17B10 Q99714 1/20 0.31
F2 P00734 2/20 0.30
PRSS1 P07477 2/20 0.30

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
SCHEMBL9867465 1.00 L3MBTL1 (0.36) L3MBTL1LMNAMEN1KMT2ASMN1; SMN2
SCHEMBL9866761 0.88 NPC1 (0.38) L3MBTL1LMNAMEN1KMT2ASMN1; SMN2
SCHEMBL9866764 0.88 NPC1 (0.38) L3MBTL1LMNAMEN1KMT2ASMN1; SMN2
SCHEMBL9866126 0.86 SMN1; SMN2 (0.48) L3MBTL1LMNAMEN1KMT2ASMN1; SMN2
SCHEMBL9866121 0.86 SMN1; SMN2 (0.48) L3MBTL1LMNAMEN1KMT2ASMN1; SMN2
SCHEMBL10642054 0.80 L3MBTL1 (0.38) L3MBTL1LMNAMEN1KMT2ASMN1; SMN2
SCHEMBL9867020 0.78 L3MBTL1 (0.38) L3MBTL1LMNAMEN1KMT2ASMN1; SMN2
SCHEMBL9867475 0.72 CA1 (0.45) L3MBTL1LMNAMEN1KMT2ASMN1; SMN2
SCHEMBL9867104 0.71 LMNA (0.40) L3MBTL1LMNAMEN1KMT2ASMN1; SMN2
SCHEMBL9868490 0.70 MEN1 (0.41) L3MBTL1LMNAMEN1KMT2ASMN1; SMN2

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