SCHEMBL9548639

SCHEMBL9548639

Cc1cn([C@H]2C[C@H](O[Si](C)(C)C(C)(C)C)[C@](CO)(CI)O2)c(=O)[nH]c1=O

nearest known ligand 0.46

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TK1 P04183 7/20 0.45
TOP2A P11388 4/20 0.43
TK2 O00142 1/20 0.42
ALB P02768 1/20 0.41
PKM P14618 1/20 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
SCHEMBL9548643 1.00 TK1 (0.45) TK1TOP2ATK2ALBPKM
SCHEMBL12942600 0.94 TK1 (0.46) TK1TOP2A
SCHEMBL9548698 0.94 TK1 (0.46) TK1TOP2A
SCHEMBL9548691 0.94 TK1 (0.46) TK1TOP2A
SCHEMBL25400182 0.91 TK1 (0.45) TK1TOP2A
SCHEMBL26274379 0.91 TK1 (0.45) TK1TOP2A
SCHEMBL8932095 0.91 TOP2A (0.43) TK1TOP2A
SCHEMBL1417620 0.88 TOP2A (0.41) TK1TOP2A
SCHEMBL9548856 0.87 TOP2A (0.41) TK1TOP2A
SCHEMBL9548859 0.87 TOP2A (0.41) TK1TOP2A

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-5192749-A Viricide, AIDS SYNTEX (U.S.A.) INC. (US) 1993-03-09 US disclosed