SCHEMBL30732482

SCHEMBL30732482

C=CC[C@]1(C(=O)OC)CC(C)(O)[C@@H](NC(=O)OC(C)(C)C)[C@H]([C@@H]2OC(C)(C)O[C@@H]2CN=[N+]=[N-])O1

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
SCHEMBL26926517 0.94 — —
SCHEMBL30732516 0.85 — —
SCHEMBL31695161 0.85 — —
SCHEMBL31695052 0.84 — —
SCHEMBL26927561 0.79 — —
SCHEMBL30732519 0.79 — —
SCHEMBL31695205 0.75 NANP (0.33) —
SCHEMBL31695155 0.67 NANP (0.33) —
SCHEMBL31695044 0.65 NANP (0.39) —
SCHEMBL26944654 0.65 NANP (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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250313574-A1 SIALIC ACID DERIVATIVES AND METHODS OF USING SAME EISAI R&D MANAGEMENT CO., LTD. (JP) 2025-10-09 — — US disclosed
EP-4536653-A2 SIALIC ACID DERIVATIVES AND METHODS OF USING SAME Eisai R&D Management Co., Ltd. (JP) 2025-04-16 — — EP disclosed
WO-2023239906-A2 SIALIC ACID DERIVATIVES AND METHODS OF USING SAME EISAI R&D MANAGEMENT CO., LTD. (JP) 2023-12-14 — — WO disclosed
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