SCHEMBL15246744

SCHEMBL15246744

Cc1cc(CC=O)cc(CN=O)c1

nearest known ligand 0.35

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ PGK1 P00558 1/20 0.35
▸ PGK2 P07205 1/20 0.35

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
SCHEMBL24080830 0.87 PGK1 (0.43) PGK1PGK2
SCHEMBL1922913 0.80 PGK1 (0.39) PGK1PGK2
SCHEMBL10225884 0.77 PGK1 (0.39) PGK1PGK2
SCHEMBL10271169 0.75 PGK1 (0.38) PGK1PGK2
SCHEMBL17366364 0.75 — —
SCHEMBL23568677 0.72 — —
SCHEMBL20242292 0.71 TACR1 (0.38) PGK1PGK2
SCHEMBL30536216 0.71 PGK1 (0.33) PGK1PGK2
SCHEMBL13224699 0.71 ALDH1A1 (0.50) PGK1PGK2
SCHEMBL3403278 0.71 PGK1 (0.33) PGK1PGK2

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-2019104-B1 Cytotoxic agents comprising new tomaymycin derivatives and their therapeutic use SANOFI SA (FR) 2013-09-04 — — EP disclosed
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