SCHEMBL29494340

SCHEMBL29494340

C[C@@H](NC(=O)c1cc(NC(=O)[C@H](N)CN)ccc1Cl)c1cccc2ccccc12

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
SCHEMBL29494285 0.89 — —
SCHEMBL29494527 0.89 — —
SCHEMBL29494495 0.89 — —
SCHEMBL29494354 0.89 — —
SCHEMBL29494377 0.87 — —
SCHEMBL29494197 0.86 MEN1 (0.52) —
SCHEMBL29494478 0.84 — —
SCHEMBL29494538 0.84 — —
SCHEMBL29494518 0.84 — —
SCHEMBL29494457 0.82 — —

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
WO-2022070048-A1 NOVEL AMIDE DERIVATIVES CADILA HEALTHCARE LIMITED (IN) 2022-04-07 — — WO claimed
WO-2022070048-A1 NOVEL AMIDE DERIVATIVES CADILA HEALTHCARE LIMITED (IN) 2022-04-07 — — WO disclosed
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