SCHEMBL15418944

SCHEMBL15418944

NC1=N[C@]2(CCO1)c1cc(I)ccc1Oc1ncc(Br)cc12

nearest known ligand 0.61

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 20/20 0.61
KCNH2 Q12809 2/20 0.39

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
SCHEMBL2519351 1.00 BACE1 (0.61) BACE1KCNH2
SCHEMBL14823712 1.00 BACE1 (0.61) BACE1KCNH2
SCHEMBL16109582 0.90 BACE1 (0.64) BACE1KCNH2
SCHEMBL14823699 0.90 BACE1 (0.64) BACE1KCNH2
SCHEMBL1994567 0.89 BACE1 (0.49) BACE1KCNH2
SCHEMBL1994569 0.89 BACE1 (0.49) BACE1KCNH2
SCHEMBL12213319 0.87 BACE1 (0.46) BACE1
SCHEMBL16109574 0.82 BACE1 (0.56) BACE1KCNH2
SCHEMBL16109576 0.82 BACE1 (0.56) BACE1KCNH2
SCHEMBL2522321 0.82 BACE1 (0.43) BACE1

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