SCHEMBL25911985

SCHEMBL25911985

CC(C)CC(=O)O[C@H]1[C@@H](O)[C@](C)(c2ccc3c(N)ncnn23)O[C@@H]1COCOC(=O)C(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
SCHEMBL25912026 0.92 — —
SCHEMBL25912032 0.92 — —
SCHEMBL25912014 0.90 — —
SCHEMBL25911999 0.90 — —
SCHEMBL25911643 0.89 RNASEL (0.33) —
SCHEMBL24916832 0.88 TMPRSS2 (0.37) —
SCHEMBL25912701 0.88 RNASEL (0.31) —
SCHEMBL24789713 0.88 DOT1L (0.30) —
SCHEMBL24917123 0.88 CA12 (0.36) —
SCHEMBL24916833 0.87 — —

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230233593-A1 ORALLY-BIOAVAILABLE NUCLEOSIDE ANALOGS VenatoRx Pharmaceuticals, Inc. 2023-07-27 — — US disclosed
US-11638715-B2 Orally-bioavailable nucleoside analogs VenatoRx Pharmaceuticals, Inc. (US) 2023-05-02 — — US disclosed
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