SCHEMBL8488277

SCHEMBL8488277

CNCCn1nc2c3c(c(NC(=O)CN)ccc31)Sc1cccnc1-2

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TOP2A P11388 1/20 0.31
MAPT P10636 1/20 0.30

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
SCHEMBL8486910 0.91 HDAC1 (0.32)
SCHEMBL8483473 0.89 TOP2A (0.42) TOP2A
SCHEMBL8482764 0.88 TOP2A (0.34) TOP2A
SCHEMBL8483307 0.87 THRB (0.37) TOP2AMAPT
SCHEMBL8485863 0.86 TOP2A (0.43) TOP2AMAPT
SCHEMBL8486549 0.83 DYRK1A (0.36) TOP2A
SCHEMBL8483655 0.82
SCHEMBL8486876 0.77 THRB (0.37) TOP2AMAPT
SCHEMBL8486373 0.77 KMT2A (0.33) MAPT
SCHEMBL8485927 0.77 TOP2A (0.47) TOP2AMAPT

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
US-5935969-A Pyrido-thiopyrandoinazoles with antitumor activity UNIVERSITY OF VERMONT (US) 1999-08-10 US disclosed