SCHEMBL15418907

SCHEMBL15418907

NC1=N[C@@]2(CCO1)c1cc(-c3cncc(F)c3)ccc1Oc1c2cc(C2=CCOCC2)nc1F

nearest known ligand 0.61

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 20/20 0.61
KCNH2 Q12809 2/20 0.55
CTSD P07339 3/20 0.52

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
SCHEMBL15418800 1.00 BACE1 (0.61) BACE1KCNH2CTSD
SCHEMBL15418692 0.89 BACE1 (0.65) BACE1CTSD
SCHEMBL15418716 0.89 BACE1 (0.65) BACE1CTSD
SCHEMBL15418969 0.89 BACE1 (0.65) BACE1KCNH2CTSD
SCHEMBL2520357 0.85 BACE1 (0.66) BACE1CTSD
SCHEMBL2528109 0.85 BACE1 (0.66) BACE1CTSD
SCHEMBL15418790 0.84 BACE1 (0.65) BACE1CTSD
SCHEMBL15418954 0.83 BACE1 (0.66) BACE1KCNH2CTSD
SCHEMBL15418806 0.83 BACE1 (0.66) BACE1KCNH2CTSD
SCHEMBL15418571 0.83 BACE1 (0.87) BACE1KCNH2CTSD

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
EP-2547686-B1 AMINO-DIHYDROOXAZINE AND AMINO-DIHYDROTHIAZINE SPIRO COMPOUNDS AS BETA-SECRETASE MODULATORS AND THEIR MEDICAL USE AMGEN INC (US) 2014-01-22 EP disclosed