SCHEMBL3432467

SCHEMBL3432467

CCN(CCC[N+]1=CC=CC1=O)Cc1cccc(OC)c1-c1cccc(CC(=O)O)c1

nearest known ligand 0.39

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
BCHE P06276 11/20 0.39
ACHE P22303 12/20 0.39
APP P05067 3/20 0.37
MAOB P27338 1/20 0.36

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
SCHEMBL13745337 0.80 BCHE (0.42) BCHEACHEAPP
SCHEMBL135067 0.76 BCHE (0.47) BCHEACHEMAOB
SCHEMBL135058 0.74 FTO (0.46) BCHEACHEMAOB
SCHEMBL137407 0.70 PTGDR2 (0.65)
SCHEMBL137320 0.69 ACHE (0.46) BCHEACHEMAOB
SCHEMBL137838 0.67 PTGDR2 (0.63)
SCHEMBL137409 0.67 FTO (0.46) BCHEACHEMAOB
SCHEMBL135057 0.63 PTGDR2 (0.56) BCHE
SCHEMBL10702420 0.62 FABP3 (0.50)
SCHEMBL2587121 0.61 SELL (0.62)

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-2257524-A1 N,N-DISUBSTITUTED AMINOALKYLBIPHENYL ANTAGONISTS OF PROSTAGLANDIN D2 RECEPTORS Amira Pharmaceuticals, Inc. (US) 2010-12-08 EP disclosed
WO-2009099902-A1 N,N-DISUBSTITUTED AMINOALKYLBIPHENYL ANTAGONISTS OF PROSTAGLANDIN D2 RECEPTORS AMIRA PHARMACEUTICALS, INC. (US) 2009-08-13 WO disclosed