SCHEMBL9524240

SCHEMBL9524240

NC(=S)CC(=O)OO

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL6040697 0.78
SCHEMBL7907029 0.75
SCHEMBL2654037 0.72
SCHEMBL2086711 0.70 DGAT1 (0.37)
SCHEMBL2791142 0.69
SCHEMBL3067654 0.67
SCHEMBL2972384 0.67
SCHEMBL2587467 0.67
SCHEMBL27954012 0.65
SCHEMBL23829821 0.65

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0431008-A4 MITOMYCIN DERIVATIVES HAVING REDUCED BONE MARROW TOXICITY, PROCESSES FOR THEIR PREPARATION, AND THE USES THEREOF 1992-03-11 EP claimed
US-5091523-A Bactericides, antitumor agent GEORGETOWN UNIVERSITY (US) 1992-02-25 US claimed
EP-0431008-A1 MITOMYCIN DERIVATIVES HAVING REDUCED BONE MARROW TOXICITY, PROCESSES FOR THEIR PREPARATION, AND THE USES THEREOF GEORGETOWN UNIVERSITY (US) 1991-06-12 EP claimed
WO-1990001931-A1 MITOMYCIN DERIVATIVES HAVING REDUCED BONE MARROW TOXICITY, PROCESSES FOR THEIR PREPARATION, AND THE USES THEREOF GEORGETOWN UNIVERSITY (US) 1990-03-08 WO claimed
EP-0533692-A1 MITOMYCIN DERIVATIVES HAVING REDUCED BONE MARROW TOXICITY, PROCESSES FOR THEIR PREPARATION, AND THE USES THEREOF GEORGETOWN UNIVERSITY (US) 1993-03-31 EP disclosed
EP-0431008-A4 MITOMYCIN DERIVATIVES HAVING REDUCED BONE MARROW TOXICITY, PROCESSES FOR THEIR PREPARATION, AND THE USES THEREOF 1992-03-11 EP disclosed
US-5091523-A Bactericides, antitumor agent GEORGETOWN UNIVERSITY (US) 1992-02-25 US disclosed
WO-1991016049-A1 MITOMYCIN DERIVATIVES HAVING REDUCED BONE MARROW TOXICITY, PROCESSES FOR THEIR PREPARATION, AND THE USES THEREOF GEORGETOWN UNIVERSITY (US) 1991-10-31 WO disclosed
EP-0431008-A1 MITOMYCIN DERIVATIVES HAVING REDUCED BONE MARROW TOXICITY, PROCESSES FOR THEIR PREPARATION, AND THE USES THEREOF GEORGETOWN UNIVERSITY (US) 1991-06-12 EP disclosed
WO-1990001931-A1 MITOMYCIN DERIVATIVES HAVING REDUCED BONE MARROW TOXICITY, PROCESSES FOR THEIR PREPARATION, AND THE USES THEREOF GEORGETOWN UNIVERSITY (US) 1990-03-08 WO disclosed