SCHEMBL9411642

SCHEMBL9411642

CN(C)c1ccc2c(CCC3CCN(Cc4ccccc4)CC3)noc2c1

nearest known ligand 0.73

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ACHE P22303 20/20 0.73
BCHE P06276 3/20 0.67

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
Fumaric Acid SCHEMBL9411338 0.93 ACHE (0.73) ACHEBCHE
Fumaric Acid SCHEMBL9411331 0.93 ACHE (0.73) ACHEBCHE
SCHEMBL4503523 0.89 ACHE (0.71) ACHEBCHE
SCHEMBL9411274 0.87 ACHE (0.67) ACHEBCHE
SCHEMBL9411480 0.85 ACHE (0.77) ACHEBCHE
SCHEMBL222209 0.85 ACHE (1.00) ACHEBCHE
SCHEMBL6987260 0.85 ACHE (1.00) ACHEBCHE
SCHEMBL955864 0.85 ACHE (1.00) ACHEBCHE
SCHEMBL9411440 0.84 ACHE (0.78) ACHEBCHE
SCHEMBL419978 0.84 ACHE (1.00) ACHEBCHE

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-0602242-A1 BENZISOXAZOLE COMPOUND AND USE THEREOF YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1994-06-22 EP claimed