Sugi Predict

Sugi Predict / Compounds / SCHEMBL9548856

SCHEMBL9548856

SCHEMBL9548856

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

nearest known ligand 0.41

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ TOP2A P11388 6/20 0.41
▸ TK1 P04183 6/20 0.40

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
SCHEMBL9548859 1.00 TOP2A (0.41) TOP2ATK1
SCHEMBL9548691 0.90 TK1 (0.46) TOP2ATK1
SCHEMBL12942600 0.90 TK1 (0.46) TOP2ATK1
SCHEMBL9548698 0.90 TK1 (0.46) TOP2ATK1
SCHEMBL25400182 0.87 TK1 (0.45) TOP2ATK1
SCHEMBL9548639 0.87 TK1 (0.45) TOP2ATK1
SCHEMBL8932095 0.87 TOP2A (0.43) TOP2ATK1
SCHEMBL9548643 0.87 TK1 (0.45) TOP2ATK1
SCHEMBL26274379 0.87 TK1 (0.45) TOP2ATK1
SCHEMBL9548766 0.85 DUT (0.39) —

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