2-Mercaptobenzothiazole

2-Mercaptobenzothiazole

SCHEMBL4268289

S=c1[nH]c2ccccc2s1.[NaH]

nearest known ligand 0.95

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PSMB8 P28062 11/20 0.95
▸ ALDH1A1 P00352 7/20 0.95
▸ KDM4E B2RXH2 4/20 0.95
▸ HPGD P15428 2/20 0.95
▸ CYP3A4 P08684 2/20 0.95
▸ TDP1 Q9NUW8 2/20 0.95
▸ ALOX15 P16050 1/20 0.95
▸ CYP1A2 P05177 2/20 0.57
▸ CYP2C19 P33261 2/20 0.57
▸ GAA P10253 2/20 0.57
▸ CYP2C9 P11712 1/20 0.57
▸ KMT2A Q03164 6/20 0.53
▸ MAPT P10636 5/20 0.53
▸ MEN1 O00255 4/20 0.53
▸ GFER P55789 1/20 0.53
▸ NPSR1 Q6W5P4 1/20 0.53
▸ CRHBP P24387 1/20 0.46
▸ CRHR2 Q13324 1/20 0.46
▸ RAB9A P51151 3/20 0.45
▸ NPC1 O15118 2/20 0.45

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 SCHEMBL408087 0.98 PSMB8 (1.00) PSMB8ALDH1A1KDM4EHPGDCYP3A4
2-Mercaptobenzothiazole SCHEMBL29433968 0.98 PSMB8 (1.00) PSMB8ALDH1A1KDM4EHPGDCYP3A4
2-Mercaptobenzothiazole SCHEMBL29729650 0.95 PSMB8 (0.95) PSMB8ALDH1A1KDM4EHPGDCYP3A4
2-Mercaptobenzothiazole SCHEMBL8749352 0.95 PSMB8 (0.95) PSMB8ALDH1A1KDM4EHPGDCYP3A4
2-Mercaptobenzothiazole SCHEMBL5934103 0.95 PSMB8 (0.95) PSMB8ALDH1A1KDM4EHPGDCYP3A4
2-Mercaptobenzothiazole SCHEMBL19514730 0.86 PSMB8 (0.78) PSMB8ALDH1A1KDM4EHPGDCYP3A4
2-Mercaptobenzothiazole SCHEMBL5933560 0.83 PSMB8 (0.72) PSMB8ALDH1A1KDM4EHPGDCYP3A4
2-Mercaptobenzothiazole SCHEMBL10897718 0.79 PSMB8 (0.66) PSMB8ALDH1A1KDM4EHPGDCYP3A4
SCHEMBL10520003 0.77 PSMB8 (0.63) PSMB8ALDH1A1KDM4EHPGDCYP3A4
SCHEMBL4622486 0.73 CMA1 (0.57) PSMB8ALDH1A1KDM4EHPGDCYP3A4

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-7476346-B2 Composition inhibiting the expansion of fire, suppressing existing fire, and methods of manufacture and use thereof FIRE JELL, INC. (US) 2009-01-13 — — US disclosed
US-20070034823-A1 Extinguishing a fire by applying an thixotropic fire fighting suspension of a pseudo-plastic high yield suspending agent and starch with a pH of 5.0-8.0; contains 99% water; clings to a surface positioned in any orientation and forms an exterior intumescent char coating upon fire contact BULK IP, LLC 2007-02-15 — — US disclosed
US-7163642-B2 Composition inhibiting the expansion of fire, suppressing existing fire, and methods of manufacture and use thereof BULK IP, LLC 2007-01-16 — — US disclosed
WO-2006042064-A2 COMPOSITION INHIBITING THE EXPANSION OF FIRE, SUPPRESSING EXISTING FIRE, AND METHODS OF MANUFACTURE AND USE THEREOF HAGQUIST JAMES ALROY E (US) 2006-04-20 — — WO disclosed
US-20060076531-A1 Composition inhibiting the expansion of fire, suppressing existing fire, and methods of manufacture and use thereof BULK IP, LLC 2006-04-13 — — US disclosed
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