SCHEMBL27407333

SCHEMBL27407333

CCCC/C(=C\C(=O)OCC)c1cnc(CCCC)n1Cc1ccccc1Cl

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
SCHEMBL9424476 0.89 — —
SCHEMBL9424469 0.89 — —
SCHEMBL9424473 0.89 — —
SCHEMBL9424428 0.82 — —
SCHEMBL9424427 0.80 — —
SCHEMBL7269753 0.80 — —
SCHEMBL7676927 0.80 — —
SCHEMBL9424550 0.79 — —
SCHEMBL9424555 0.79 — —
SCHEMBL9424545 0.79 — —

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
CN-1079648-A Preparation contains the method for the pharmaceutical composition of imidazolyl-alkenoic acids SMITHKLINE BEECHAM CORP (US) 1993-12-22 — — CN disclosed
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