SCHEMBL21372391

SCHEMBL21372391

Cc1cc2ncc(=O)n3c2n(c1=O)CC3COS(C)(=O)=O

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TOP2A P11388 1/20 0.33

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
SCHEMBL21372395 0.92 TOP2A (0.32) TOP2A
SCHEMBL335589 0.82 TOP2A (0.44) TOP2A
SCHEMBL13299183 0.82 TOP2A (0.44) TOP2A
SCHEMBL21371873 0.82 TOP2A (0.32) TOP2A
SCHEMBL13114362 0.82 TOP2A (0.33) TOP2A
SCHEMBL335482 0.80 TOP2A (0.40) TOP2A
SCHEMBL12113946 0.78 BRD4 (0.30)
SCHEMBL3360410 0.76 TOP2A (0.38) TOP2A
SCHEMBL21371930 0.73 TOP2A (0.33) TOP2A
SCHEMBL13114517 0.69 TOP2A (0.34) TOP2A

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-3639824-A1 TRICYCLIC NITROGEN CONTAINING COMPOUNDS FOR TREATING NEISSERIA GONORRHOEA INFECTION GlaxoSmithKline Intellectual Property Development Limited (GB) 2020-04-22 EP disclosed
EP-3182973-B1 TRICYCLIC NITROGEN CONTAINING COMPOUNDS FOR TREATING NEISSERIA GONORRHOEA INFECTION GLAXOSMITHKLINE IP DEV LTD (GB) 2019-09-18 EP disclosed