SCHEMBL7719670

SCHEMBL7719670

CN1C(=O)C2(CC3(CCC3)Cc3ccc(-c4cccc(CC(F)F)c4)cc32)N=C1N

nearest known ligand 0.56

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 20/20 0.56
CTSD P07339 18/20 0.56

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
SCHEMBL7713911 0.92 CTSD (0.54) BACE1CTSD
SCHEMBL7719733 0.88 CTSD (0.67) BACE1CTSD
SCHEMBL464596 0.84 BACE1 (0.66) BACE1CTSD
SCHEMBL431055 0.83 BACE1 (0.63) BACE1CTSD
SCHEMBL427968 0.82 BACE1 (0.64) BACE1CTSD
SCHEMBL7719982 0.81 BACE1 (0.57) BACE1CTSD
SCHEMBL430751 0.78 BACE1 (0.78) BACE1CTSD
SCHEMBL430454 0.77 BACE1 (0.66) BACE1CTSD
SCHEMBL427972 0.76 BACE1 (0.60) BACE1CTSD
SCHEMBL430753 0.76 BACE1 (0.78) BACE1CTSD

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
WO-2011123674-A1 COMPOUNDS FOR TREATING NEURODEGENERATIVE DISEASES ARRAY BIOPHARMA INC. (US) 2011-10-06 WO disclosed