SCHEMBL8807166

SCHEMBL8807166

COc1cc2oc(=O)c3c(c2cc1OCCCCCN1CCC(c2ccccc2)CC1)CCC3

nearest known ligand 0.61

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ACHE P22303 4/20 0.53
BCHE P06276 3/20 0.53

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
SCHEMBL8808311 0.99 ACHE (0.54) ACHEBCHE
SCHEMBL8806888 0.97 ACHE (0.53) ACHEBCHE
SCHEMBL8808418 0.95 ACHE (0.56) ACHEBCHE
SCHEMBL8807154 0.94 ACHE (0.53) ACHEBCHE
SCHEMBL8809090 0.86 BCHE (0.54) ACHEBCHE
SCHEMBL8809835 0.85 BCHE (0.54) ACHEBCHE
SCHEMBL8809511 0.85 ACHE (0.70) ACHEBCHE
SCHEMBL8808991 0.84 EGFR (0.52) ACHE
SCHEMBL8810369 0.82 DRD2 (0.56) ACHEBCHE
SCHEMBL8808462 0.81 DRD2 (0.54)

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0584091-B1 BENZOPYRANONES, METHODS OF MANUFACTURE AND USE THEREOF SCHWABE WILLMAR GMBH & CO (DE) 1997-01-15 EP disclosed
US-5428038-A Administering for preventing or treating N-methyl-D-aspartate induced convulsions DR. WILLMAR SCHWABE GMBH & CO. (DE) 1995-06-27 US disclosed