SCHEMBL9868564

SCHEMBL9868564

CCO/C=N\S(=O)(=O)c1nc(-c2ccccc2Cl)ns1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
L3MBTL1 Q9Y468 4/20 0.37
ALDH1A1 P00352 3/20 0.37
MAPT P10636 2/20 0.37
AKR1B1 P15121 1/20 0.34
EGFR P00533 2/20 0.34
TUBB4A P04350 2/20 0.34
TUBB P07437 2/20 0.34
TUBA3C P0DPH7 2/20 0.34
TUBA1B P68363 2/20 0.34
TUBA4A P68366 2/20 0.34
TUBB4B P68371 2/20 0.34
TUBB3 Q13509 2/20 0.34
TUBB2A Q13885 2/20 0.34
TUBB8 Q3ZCM7 2/20 0.34
TUBA3E Q6PEY2 2/20 0.34
TUBA1A Q71U36 2/20 0.34
TUBA1C Q9BQE3 2/20 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
SCHEMBL9868570 1.00 NPC1 (0.39) NPC1RAB9ASMN1; SMN2L3MBTL1ALDH1A1
SCHEMBL9866500 0.80 NPC1 (0.39) NPC1RAB9ASMN1; SMN2L3MBTL1ALDH1A1
SCHEMBL9867029 0.79 NPC1 (0.41) NPC1RAB9ASMN1; SMN2L3MBTL1ALDH1A1
SCHEMBL9867023 0.79 NPC1 (0.41) NPC1RAB9ASMN1; SMN2L3MBTL1ALDH1A1
SCHEMBL10641567 0.76 NPC1 (0.41) NPC1RAB9ASMN1; SMN2L3MBTL1ALDH1A1
SCHEMBL9868254 0.72 CA1 (0.54) NPC1RAB9ASMN1; SMN2L3MBTL1ALDH1A1
SCHEMBL9866764 0.72 NPC1 (0.38) NPC1RAB9ASMN1; SMN2L3MBTL1ALDH1A1
SCHEMBL9866761 0.72 NPC1 (0.38) NPC1RAB9ASMN1; SMN2L3MBTL1ALDH1A1
SCHEMBL9868490 0.72 MEN1 (0.41) NPC1RAB9ASMN1; SMN2L3MBTL1ALDH1A1
SCHEMBL9868500 0.72 MEN1 (0.41) NPC1RAB9ASMN1; SMN2L3MBTL1ALDH1A1

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