2-Mercaptobenzothiazole

2-Mercaptobenzothiazole

SCHEMBL9414129

CN(C)C(=S)[S-].CN(C)C(=S)[S-].CN(C)C(=S)[S-].CN(C)C(=S)[S-].Sc1nc2ccccc2s1.[Zn+2].[Zn+2]

nearest known ligand 0.51

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 6/20 0.51
▸ MAPT P10636 6/20 0.51
▸ NPC1 O15118 5/20 0.51
▸ ALDH1A1 P00352 5/20 0.51
▸ KMT2A Q03164 4/20 0.51
▸ LMNA P02545 3/20 0.51
▸ TDP1 Q9NUW8 3/20 0.51
▸ L3MBTL1 Q9Y468 2/20 0.51
▸ POLB P06746 2/20 0.51
▸ NFKB1 P19838 1/20 0.51
▸ MPI P34949 1/20 0.51
▸ NFKB2 Q00653 1/20 0.51
▸ RELA Q04206 1/20 0.51
▸ NPSR1 Q6W5P4 1/20 0.51
▸ SMN1; SMN2 Q16637 4/20 0.43
▸ TP53 P04637 1/20 0.43
▸ CASP3 P42574 1/20 0.43
▸ SENP8 Q96LD8 1/20 0.43
▸ SENP7 Q9BQF6 1/20 0.43
▸ SENP6 Q9GZR1 1/20 0.43

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
2-Mercaptobenzothiazole SCHEMBL9414126 0.88 MAPT (0.54) RAB9AMAPTNPC1ALDH1A1KMT2A
Thiram SCHEMBL28241126 0.84 NPC1 (0.50) RAB9AMAPTNPC1ALDH1A1KMT2A
2-Mercaptobenzothiazole SCHEMBL28848018 0.83 CA12 (0.43) RAB9AMAPTNPC1ALDH1A1KMT2A
2-Mercaptobenzothiazole SCHEMBL9132603 0.80 MAPT (0.56) RAB9AMAPTNPC1ALDH1A1KMT2A
2-Mercaptobenzothiazole SCHEMBL29358081 0.80 ALDH1A1 (0.52) RAB9AMAPTNPC1ALDH1A1KMT2A
2-Mercaptobenzothiazole SCHEMBL29167846 0.80 ALDH1A1 (0.50) RAB9AMAPTNPC1ALDH1A1KMT2A
2-Mercaptobenzothiazole SCHEMBL29509878 0.80 ALDH1A1 (0.54) RAB9AMAPTNPC1ALDH1A1KMT2A
2-Mercaptobenzothiazole SCHEMBL3789760 0.80 ALDH1A1 (0.54) RAB9AMAPTNPC1ALDH1A1KMT2A
2-Mercaptobenzothiazole SCHEMBL23237 0.80 ALDH1A1 (0.54) RAB9AMAPTNPC1ALDH1A1KMT2A
2-Mercaptobenzothiazole SCHEMBL28119033 0.79 ALDH1A1 (0.46) RAB9AMAPTNPC1ALDH1A1KMT2A

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
EP-0616015-A2 Fungicidal protective coating for air handling equipment FOSTER PRODUCTS CORPORATION (US) 1994-09-21 — — EP claimed
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