SCHEMBL9655145

SCHEMBL9655145

CC(=O)Oc1c(C)c(C)c2c(c1C)CCC(C)(C(=O)Nc1cc(C)c3ccccc3n1)O2

nearest known ligand 0.49

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
BCHE P06276 16/20 0.49
ACHE P22303 16/20 0.49
TTPA P49638 2/20 0.49
ALOX5 P09917 1/20 0.43
PDE10A Q9Y233 1/20 0.41

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

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
SCHEMBL9250567 0.91 BCHE (0.44) BCHEACHETTPAALOX5PDE10A
SCHEMBL9313618 0.91 BCHE (0.49) BCHEACHETTPA
SCHEMBL9314049 0.88 BCHE (0.62) BCHEACHE
SCHEMBL9312863 0.88 BCHE (0.50) BCHEACHE
SCHEMBL9314083 0.87 BCHE (0.49) BCHEACHE
SCHEMBL9313964 0.87 BCHE (0.49) BCHEACHETTPAALOX5
SCHEMBL9314117 0.85 MEN1 (0.45) BCHEACHETTPAALOX5PDE10A
SCHEMBL9655253 0.85 BCHE (0.48) BCHEACHE
SCHEMBL9314055 0.85 PSEN1 (0.48) BCHEACHE
SCHEMBL9312767 0.83 MEN1 (0.46) BCHEACHETTPAALOX5

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-0512899-A1 Benzopyran compounds, process for their preparation and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 1992-11-11 EP disclosed