SCHEMBL28429125

SCHEMBL28429125

CNC(=O)CC(Nc1nc2ccccc2[nH]1)c1cccc(NS(C)(=O)=O)c1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 3/20 0.47
▸ HTT P42858 2/20 0.47
▸ NPC1 O15118 1/20 0.47
▸ RAB9A P51151 1/20 0.47
▸ ITGB3 P05106 4/20 0.46
▸ ITGAV P06756 4/20 0.46
▸ AKR1C3 P42330 1/20 0.41
▸ MEN1 O00255 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ KDM4E B2RXH2 1/20 0.41
▸ MAPK1 P28482 1/20 0.41
▸ MTOR P42345 1/20 0.40
▸ LMNA P02545 1/20 0.40
▸ GRIN1 Q05586 1/20 0.39
▸ GRIN2B Q13224 1/20 0.39
▸ MPO P05164 1/20 0.39

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
SCHEMBL20743093 0.82 IRAK4 (0.53) SMN1; SMN2HTTNPC1RAB9AITGB3
SCHEMBL20743189 0.82 NPC1 (0.48) SMN1; SMN2HTTNPC1RAB9AITGB3
SCHEMBL30645121 0.82 NPC1 (0.48) SMN1; SMN2HTTNPC1RAB9AITGB3
SCHEMBL30645027 0.82 IRAK4 (0.53) SMN1; SMN2HTTNPC1RAB9AITGB3
SCHEMBL20743761 0.82 NPC1 (0.47) SMN1; SMN2HTTNPC1RAB9AMEN1
SCHEMBL30645019 0.82 NPC1 (0.47) SMN1; SMN2HTTNPC1RAB9AMEN1
SCHEMBL20743099 0.82 RAB9A (0.48) SMN1; SMN2HTTNPC1RAB9AAKR1C3
SCHEMBL20743140 0.80 SMN1; SMN2 (0.47) SMN1; SMN2HTTNPC1RAB9AMEN1
SCHEMBL30645024 0.80 SMN1; SMN2 (0.47) SMN1; SMN2HTTNPC1RAB9AMEN1
SCHEMBL20743025 0.80 MTOR (0.49) SMN1; SMN2HTTNPC1RAB9AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111344281-B Potassium channel inhibitors substituted benzimidazoles 阿塞西翁制药公司 2023-11-14 — — CN claimed
CN-111344281-A Potassium channel inhibitors of substituted benzimidazoles 阿塞西翁制药公司 2020-06-26 — — CN claimed
CN-111344281-B Potassium channel inhibitors substituted benzimidazoles 阿塞西翁制药公司 2023-11-14 — — CN disclosed
CN-111344281-A Potassium channel inhibitors of substituted benzimidazoles 阿塞西翁制药公司 2020-06-26 — — CN disclosed
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