SCHEMBL6936016

SCHEMBL6936016

Cc1c(CCO)sc[n+]1CC(=O)C(C)(C)C

nearest known ligand 0.50

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TKT P29401 15/20 0.46
HSP90AA1 P07900 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
Bromide SCHEMBL3844690 0.98 TKT (0.45) TKTHSP90AA1
SCHEMBL5015373 0.81 TKT (0.51) TKTHSP90AA1
Hydrochloric Acid SCHEMBL3849477 0.81 TKT (0.51) TKTHSP90AA1
SCHEMBL20799984 0.81 TKT (0.43) TKTHSP90AA1
Bromide SCHEMBL7400580 0.80 TKT (0.50) TKTHSP90AA1
SCHEMBL6936407 0.79 TKT (0.46) TKTHSP90AA1
Bromide SCHEMBL7400578 0.79 TKT (0.49) TKTHSP90AA1
Bromide SCHEMBL2946803 0.78 TKT (0.46) TKTHSP90AA1
Hydrochloric Acid SCHEMBL3845158 0.78 KMT2A (0.50)
Bromide SCHEMBL7820785 0.77 TKT (0.44) TKTHSP90AA1

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
EP-0808163-B1 USE OF THIAZOLIUM COMPOUNDS FOR PREVENTING AND REVERSING THE FORMATION OF ADVANCED GLYCOSYLATION ENDPRODUCTS ALTEON INC (US) 2003-07-23 EP claimed
US-6440749-B1 ADMINISTERING A THIAZOLE COMPOUND ALTEON. INC. 2002-08-27 US claimed