SCHEMBL30166699

SCHEMBL30166699

CC(=O)Nc1nc2ccc(NS(=O)(=O)c3cccs3)cc2s1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 10/20 0.69
▸ KMT2A Q03164 10/20 0.69
▸ KDM4E B2RXH2 7/20 0.69
▸ MAPT P10636 6/20 0.69
▸ ALDH1A1 P00352 5/20 0.69
▸ MAPK1 P28482 4/20 0.69
▸ HPGD P15428 4/20 0.69
▸ GAA P10253 2/20 0.69
▸ LMNA P02545 3/20 0.66
▸ SENP7 Q9BQF6 3/20 0.62
▸ RAB9A P51151 3/20 0.62
▸ NPC1 O15118 1/20 0.62
▸ PKM P14618 2/20 0.59
▸ LDHA P00338 1/20 0.57
▸ TSHR P16473 1/20 0.56
▸ HTT P42858 1/20 0.56
▸ POLB P06746 2/20 0.56
▸ NPSR1 Q6W5P4 1/20 0.56
▸ CLK1 P49759 1/20 0.56
▸ CASP3 P42574 2/20 0.55

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
SCHEMBL24812486 1.00 MEN1 (0.69) MEN1KMT2AKDM4EMAPTALDH1A1
SCHEMBL28648254 0.86 MEN1 (0.62) MEN1KMT2AKDM4EMAPTALDH1A1
SCHEMBL30166738 0.86 MEN1 (0.62) MEN1KMT2AKDM4EMAPTALDH1A1
SCHEMBL30166743 0.85 MEN1 (0.64) MEN1KMT2AKDM4EMAPTALDH1A1
SCHEMBL28651370 0.85 MEN1 (0.64) MEN1KMT2AKDM4EMAPTALDH1A1
SCHEMBL30166745 0.84 MEN1 (0.61) MEN1KMT2AKDM4EMAPTALDH1A1
SCHEMBL28656599 0.84 MEN1 (0.61) MEN1KMT2AKDM4EMAPTALDH1A1
SCHEMBL28638012 0.84 MEN1 (0.62) MEN1KMT2AKDM4EMAPTALDH1A1
SCHEMBL30166723 0.84 MEN1 (0.62) MEN1KMT2AKDM4EMAPTALDH1A1
SCHEMBL24812919 0.83 MEN1 (0.61) MEN1KMT2AKDM4EMAPTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112812111-B Benzothiazole compound and medical application thereof 中国药科大学 2023-01-31 — — CN disclosed
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