SCHEMBL8283445

SCHEMBL8283445

CCc1cc(C2(NC[C@@H](O)CCc3cc(F)cc(F)c3)CCCCC2)cs1

nearest known ligand 0.48

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 20/20 0.48
CTSD P07339 9/20 0.48

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
SCHEMBL2873462 1.00 BACE1 (0.48) BACE1CTSD
SCHEMBL2879615 0.86 BACE1 (0.64) BACE1CTSD
SCHEMBL8281521 0.86 BACE1 (0.64) BACE1CTSD
SCHEMBL8282835 0.82 BACE1 (0.64) BACE1CTSD
SCHEMBL5668545 0.82 BACE1 (0.55) BACE1CTSD
SCHEMBL8282810 0.82 BACE1 (0.55) BACE1CTSD
SCHEMBL2877157 0.80 BACE1 (0.48) BACE1CTSD
SCHEMBL5666476 0.78 BACE1 (0.78) BACE1CTSD
SCHEMBL5734855 0.78 BACE1 (0.67) BACE1CTSD
SCHEMBL8283519 0.78 BACE1 (0.48) 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-2005087215-A1 SUBSTITUTED UREA AND CARBAMATE, PHENACYL-2-HYDROXY-3-DIAMINOALKANE, AND BENZAMIDE-2-HYDROXY-3-DIAMINOALKANE ASPARTYL-PROTEASE INHIBITORS ELAN PHARMACEUTICALS, INC. (US) 2005-09-22 WO disclosed