SCHEMBL26238566

SCHEMBL26238566

COC(=O)OC1[C@@]2(C)O[C@@H](c3ccc4c(/N=C\N(C)C)ncnn34)[C@@H]3OC(C)(C)O[C@@]132

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
SCHEMBL26239588 0.91 — —
SCHEMBL26237686 0.85 — —
SCHEMBL26831296 0.85 — —
SCHEMBL26831371 0.77 — —
SCHEMBL26831493 0.77 — —
SCHEMBL26237833 0.76 POLRMT (0.35) —
SCHEMBL26832289 0.76 POLRMT (0.35) —
SCHEMBL26240621 0.76 — —
SCHEMBL26239567 0.75 POLRMT (0.34) —
SCHEMBL26238600 0.75 POLRMT (0.36) —

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
WO-2023168254-A1 ANTIVIRAL COMPOUNDS AND METHODS OF MAKING AND USING THE SAME GILEAD SCIENCES, INC. (US) 2023-09-07 — — WO disclosed
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