SCHEMBL7723154

SCHEMBL7723154

CCc1cccc(-c2ccc3c(c2)C2(COC(N)=N2)C(C)(C)CC3)c1

nearest known ligand 0.51

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 19/20 0.51
KCNH2 Q12809 2/20 0.51
TAAR1 Q96RJ0 1/20 0.40

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
SCHEMBL430541 0.83 BACE1 (0.62) BACE1KCNH2
SCHEMBL430565 0.80 BACE1 (0.61) BACE1KCNH2
SCHEMBL428052 0.76 BACE1 (0.64) BACE1KCNH2
SCHEMBL430564 0.75 BACE1 (0.62) BACE1KCNH2
SCHEMBL14053739 0.68 BACE1 (0.55) BACE1
SCHEMBL14053740 0.68 BACE1 (0.55) BACE1
SCHEMBL15831390 0.67 BACE1 (1.00) BACE1KCNH2
SCHEMBL14053103 0.65 BACE1 (0.59) BACE1KCNH2
SCHEMBL14053104 0.65 BACE1 (0.59) BACE1KCNH2
SCHEMBL14053329 0.65 BACE1 (0.46) BACE1KCNH2

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