SCHEMBL14724604

SCHEMBL14724604

CNC(=O)C(C(=O)NN=O)N(C)C(=O)c1ccc(C#Cc2ccc(C(=O)N(C)C(C(N)=O)C(=O)OC)cc2)cc1

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
SCHEMBL14724519 0.84 — —
SCHEMBL14714455 0.82 — —
SCHEMBL14714537 0.78 — —
SCHEMBL14714695 0.78 — —
SCHEMBL14724620 0.77 ACACB (0.36) —
SCHEMBL14714360 0.76 — —
SCHEMBL14789080 0.75 — —
SCHEMBL14724550 0.75 PLK1 (0.44) —
SCHEMBL14714666 0.74 — —
SCHEMBL14724585 0.74 HRH3 (0.40) —

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
EP-2562155-A1 NOVEL HYDROXAMIC ACID DERIVATIVE Taisho Pharmaceutical Co., Ltd. (JP) 2013-02-27 — — EP disclosed
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