SCHEMBL882992

SCHEMBL882992

CN(C=O)/C(N)=N\C1c2cc(-c3cncnc3)ccc2OC2CC(F)CCC21

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CTSD P07339 1/20 0.31
BACE1 P56817 1/20 0.31

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
SCHEMBL882648 0.91 BACE1 (0.35) CTSDBACE1
SCHEMBL10266405 0.85 BACE1 (0.32) CTSDBACE1
SCHEMBL10270522 0.79 BACE1 (0.36) CTSDBACE1
SCHEMBL882893 0.78 BACE1 (0.36) CTSDBACE1
SCHEMBL10266039 0.76 BACE1 (0.35) CTSDBACE1
SCHEMBL882988 0.73 BACE1 (0.32) CTSDBACE1
SCHEMBL10266487 0.72 BACE1 (0.35) CTSDBACE1
SCHEMBL10266083 0.71 BACE1 (0.34) CTSDBACE1
SCHEMBL7708344 0.71 ERN1 (0.32) BACE1
SCHEMBL10265452 0.70 BACE1 (0.34) CTSDBACE1

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-2012040641-A2 COMPOUNDS FOR TREATING NEURODEGENERATIVE DISEASES ARRAY BIOPHARMA INC. (US) 2012-03-29 WO disclosed