SCHEMBL6845485

SCHEMBL6845485

N=C(N)OC[C@@H]1c2cc(-c3cccnc3F)ccc2Oc2c1cc(C1CC1)nc2F

nearest known ligand 0.46

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 20/20 0.46
CTSD P07339 1/20 0.37

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
SCHEMBL6845531 0.79 BACE1 (0.33) BACE1CTSD
SCHEMBL6845659 0.76 BACE1 (0.53) BACE1CTSD
SCHEMBL16229143 0.67 BACE1 (0.90) BACE1CTSD
SCHEMBL10285710 0.67 BACE1 (0.51) BACE1CTSD
SCHEMBL12212608 0.66 BACE1 (0.68) BACE1CTSD
SCHEMBL2372290 0.63 BACE1 (1.00) BACE1CTSD
SCHEMBL2383552 0.63 BACE1 (1.00) BACE1CTSD
SCHEMBL2380284 0.62 BACE1 (0.76) BACE1CTSD
SCHEMBL2520572 0.62 BACE1 (0.76) BACE1CTSD
SCHEMBL10285405 0.61 BACE1 (0.42) 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-2011115938-A1 SPIRO-TETRACYCLIC RING COMPOUNDS AS BETA - SECRETASE MODULATORS AMGEN INC. (US) 2011-09-22 WO disclosed