SCHEMBL29478327

SCHEMBL29478327

CC(C)(C)OC(=O)N(Cc1cc2ccc([C@H]3CC(=O)[C@@H]4OC(C)(C)O[C@H]34)cc2n1C(=O)OC(C)(C)C)CC12CC(F)(C1)C2

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
SCHEMBL29478320 0.88 — —
SCHEMBL27178360 0.82 — —
SCHEMBL24293717 0.79 — —
SCHEMBL29478314 0.79 USP30 (0.35) —
SCHEMBL29478313 0.77 BACE1 (0.37) —
SCHEMBL24293443 0.77 BACE1 (0.37) —
SCHEMBL29478318 0.77 METTL3 (0.42) —
SCHEMBL29478334 0.77 METTL3 (0.35) —
SCHEMBL24293496 0.77 — —
SCHEMBL23458923 0.75 NR1H2 (0.32) —

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-2022074391-A1 COMPOUNDS INHIBITORS OF METTL3 STORM THERAPEUTICS LIMITED (GB) 2022-04-14 — — WO disclosed
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