SCHEMBL21975910

SCHEMBL21975910

COC(C)(C)CCOC(C)(C)CCOCCCCC(=O)ON1C(=O)CCC1=O

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
SCHEMBL14816520 0.90 — —
SCHEMBL14969556 0.89 — —
SCHEMBL19646887 0.88 — —
SCHEMBL12180768 0.83 — —
SCHEMBL8214570 0.81 — —
SCHEMBL28711763 0.81 ALOX12 (0.36) —
SCHEMBL13601925 0.80 HPGD (0.33) —
SCHEMBL22415484 0.80 DGKA (0.31) —
SCHEMBL14712371 0.80 PSMB8 (0.30) —
SCHEMBL10055988 0.80 HPGD (0.37) —

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
US-20200138946-A1 STABILIZED AQUEOUS ANTIBODY COMPOSITIONS ARECOR LIMITED (GB) 2020-05-07 — — US disclosed
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