SCHEMBL9173123

SCHEMBL9173123

Cc1ccccc1-c1[nH]nnc1S(=O)(=O)O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 1/20 0.39
▸ NOTUM Q6P988 1/20 0.36
▸ RAB9A P51151 5/20 0.36
▸ SMN1; SMN2 Q16637 4/20 0.36
▸ NPC1 O15118 4/20 0.36
▸ CASP3 P42574 1/20 0.36
▸ SENP8 Q96LD8 1/20 0.36
▸ SENP7 Q9BQF6 1/20 0.36
▸ SENP6 Q9GZR1 1/20 0.36
▸ ALDH1A1 P00352 3/20 0.36
▸ HPGD P15428 3/20 0.36
▸ KDM4E B2RXH2 3/20 0.36
▸ MAPT P10636 2/20 0.36
▸ PKM P14618 2/20 0.36
▸ MEN1 O00255 2/20 0.36
▸ LMNA P02545 2/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ APAF1 O14727 1/20 0.36
▸ TDP2 O95551 1/20 0.36
▸ MAOB P27338 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
SCHEMBL4439054 0.77 SMN1; SMN2 (0.38) GAARAB9ASMN1; SMN2NPC1ALDH1A1
SCHEMBL1290355 0.73 HPGD (0.41) GAANOTUMRAB9ASMN1; SMN2NPC1
SCHEMBL28327759 0.73 GAA (0.46) GAANOTUMRAB9ASMN1; SMN2NPC1
SCHEMBL27599916 0.71 GAA (0.44) GAANOTUMRAB9ASMN1; SMN2NPC1
SCHEMBL2918163 0.71 PIK3CD (0.49) GAANOTUMRAB9ASMN1; SMN2NPC1
SCHEMBL30839322 0.71 GAA (0.41) GAANOTUMRAB9ASMN1; SMN2NPC1
SCHEMBL28805494 0.71 GAA (0.45) GAANOTUMRAB9ASMN1; SMN2NPC1
SCHEMBL7599243 0.71 GAA (0.38) GAANOTUMRAB9ASMN1; SMN2NPC1
SCHEMBL29818805 0.70 KDM4E (0.41) GAANOTUMRAB9ASMN1; SMN2NPC1
SCHEMBL28264086 0.69 ALDH1A1 (0.45) GAANOTUMRAB9ASMN1; SMN2NPC1

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
US-5378373-A Chelation with benzotriazolesulfonates BETZ LABORATORIES, INC. (US) 1995-01-03 — — US claimed
US-5378373-A Chelation with benzotriazolesulfonates BETZ LABORATORIES, INC. (US) 1995-01-03 — — US disclosed
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