SCHEMBL26333296

SCHEMBL26333296

CC(C)C(=O)O[C@H]1[C@H](c2ccc3c(N)ncnn23)O[C@](C#N)(CO[PH](=O)N[C@@H](C)C(=O)OCC2CCOCC2)[C@H]1OC(=O)C(C)C

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
SCHEMBL26332328 0.94 — —
SCHEMBL23819219 0.92 — —
SCHEMBL26333872 0.90 POLRMT (0.33) —
SCHEMBL23818796 0.88 POLRMT (0.31) —
SCHEMBL23818562 0.84 POLRMT (0.31) —
SCHEMBL23803316 0.84 POLRMT (0.31) —
SCHEMBL26331255 0.84 POLRMT (0.31) —
SCHEMBL23818940 0.84 POLRMT (0.31) —
SCHEMBL26332371 0.84 PIK3CD (0.32) —
SCHEMBL23818503 0.83 POLRMT (0.33) —

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-11767337-B2 Antiviral compounds GILEAD SCIENCES, INC. (US) 2023-09-26 — — US disclosed
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