SCHEMBL9563446

SCHEMBL9563446

CCC1(O)C(=O)OCc2c1cc1n(c2=O)Cc2c-1nc1cc3c(cc1c2CO)OCO3

nearest known ligand 0.89

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ TOP1 P11387 19/20 0.89
▸ SLC2A1 P11166 1/20 0.71

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
SCHEMBL21450459 1.00 TOP1 (0.89) TOP1SLC2A1
SCHEMBL15711952 0.94 TOP1 (1.00) TOP1SLC2A1
SCHEMBL24642747 0.93 TOP1 (0.86) TOP1SLC2A1
SCHEMBL21450485 0.92 TOP1 (0.87) TOP1SLC2A1
SCHEMBL21564110 0.92 TOP1 (0.87) TOP1SLC2A1
SCHEMBL29877390 0.92 TOP1 (0.87) TOP1SLC2A1
SCHEMBL21450329 0.92 TOP1 (0.87) TOP1SLC2A1
SCHEMBL23235265 0.92 TOP1 (1.00) TOP1SLC2A1
SCHEMBL25403177 0.92 TOP1 (1.00) TOP1SLC2A1
SCHEMBL29728060 0.92 TOP1 (1.00) TOP1SLC2A1

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-0556585-A2 Condensed camptothecin derivatives their production and use as antitumor agents TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1993-08-25 — — EP disclosed
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