SCHEMBL24613864

SCHEMBL24613864

B[C@@H]1O[C@H](COP(=O)(S)OC2C(OCCOC)[C@H](B)O[C@@H]2CO)C(OCCS)C1OCCOC

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL23984435 0.88 FBP1 (0.34) —
SCHEMBL20329197 0.83 — —
SCHEMBL26474203 0.83 — —
SCHEMBL20334736 0.78 — —
SCHEMBL13706079 0.76 TLR4 (0.31) —
SCHEMBL26029385 0.76 TLR4 (0.31) —
SCHEMBL22736772 0.76 FBP1 (0.37) —
SCHEMBL27104772 0.75 TLR4 (0.30) —
SCHEMBL19577789 0.74 — —
SCHEMBL24211093 0.74 — —

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-11382981-B2 Exon skipping oligomer conjugates for muscular dystrophy SAREPTA THERAPEUTICS, INC. (US) 2022-07-12 — — US disclosed
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