SCHEMBL9655253

SCHEMBL9655253

CCOC(=O)COc1c(C)c(C)c2c(c1C)CCC(C)(C(=O)Nc1cc(C)c3ccccc3n1)O2

nearest known ligand 0.48

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
BCHE P06276 14/20 0.48
ACHE P22303 14/20 0.48
PSEN1 P49768 6/20 0.44

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
SCHEMBL9312863 0.92 BCHE (0.50) BCHEACHEPSEN1
SCHEMBL9313618 0.89 BCHE (0.49) BCHEACHEPSEN1
SCHEMBL9314055 0.89 PSEN1 (0.48) BCHEACHEPSEN1
SCHEMBL9314083 0.88 BCHE (0.49) BCHEACHEPSEN1
SCHEMBL9655145 0.85 BCHE (0.49) BCHEACHE
SCHEMBL9313737 0.84 PSEN1 (0.51) BCHEACHEPSEN1
SCHEMBL9313766 0.84 PSEN1 (0.45) BCHEACHEPSEN1
SCHEMBL9314049 0.84 BCHE (0.62) BCHEACHE
SCHEMBL9250567 0.77 BCHE (0.44) BCHEACHEPSEN1
SCHEMBL14948954 0.76 PSEN1 (0.67) PSEN1

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