SCHEMBL19619013

SCHEMBL19619013

Cc1cn([C@H]2CCCC(O[Si](C)(C)C(C)(C)C)C2)c(=O)[nH]c1=O

nearest known ligand 0.42

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TOP2A P11388 6/20 0.42
TK1 P04183 4/20 0.41

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
SCHEMBL15743265 1.00 TOP2A (0.42) TOP2ATK1
SCHEMBL9297712 0.77 ALDH1A1 (0.47) TK1
SCHEMBL17174586 0.75 TK1 (0.43) TK1
SCHEMBL19619045 0.74 TK1 (0.51) TK1
SCHEMBL19619010 0.74 TK1 (0.48) TK1
SCHEMBL23270835 0.73 TOP2A (0.51) TOP2ATK1
SCHEMBL24059076 0.73 TOP2A (0.51) TOP2ATK1
SCHEMBL12942602 0.73 TOP2A (0.51) TOP2ATK1
SCHEMBL1417792 0.73 TOP2A (0.46) TOP2ATK1
SCHEMBL1417955 0.73 TOP2A (0.46) TOP2ATK1

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-9822137-B2 Phosphonucleosides useful in the treatment of viral disorders UNIVERSITY COLLEGE CORK (IE) 2017-11-21 US disclosed