SCHEMBL23819003

SCHEMBL23819003

CCC(CC)COC(=O)[C@H](C)NP(=O)(N[C@@H](C)C(=O)OCC(CC)CC)OCC(C#N)(OC)[C@@H](OC(C)=O)[C@@H](OC(C)=O)c1ccc2c(N)ncnn12

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
SCHEMBL23819055 0.93 RIPK1 (0.30) —
SCHEMBL23819113 0.93 — —
SCHEMBL23819180 0.92 RIPK1 (0.31) —
SCHEMBL26332496 0.91 RIPK1 (0.31) —
SCHEMBL23818668 0.91 RIPK1 (0.31) —
SCHEMBL26333768 0.88 — —
SCHEMBL23819343 0.88 — —
SCHEMBL26337904 0.87 RIPK1 (0.32) —
SCHEMBL23818683 0.86 RIPK1 (0.31) —
SCHEMBL26333931 0.86 RIPK1 (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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11767337-B2 Antiviral compounds GILEAD SCIENCES, INC. (US) 2023-09-26 — — US disclosed
US-20210284670-A1 ANTIVIRAL COMPOUNDS GILEAD SCIENCES, INC. 2021-09-16 — — US disclosed
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