SCHEMBL15241663

SCHEMBL15241663

C[C@H]1OC[C@]2(c3cc(NC(=O)c4cnc(C(F)F)cn4)ccc3F)N=C(NC(=O)OC(C)(C)C)OC[C@H]12

nearest known ligand 0.66

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 17/20 0.66
BACE2 Q9Y5Z0 9/20 0.53

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
SCHEMBL15225050 0.86 BACE1 (0.58) BACE1BACE2
SCHEMBL15338545 0.86 BACE1 (0.58) BACE1BACE2
SCHEMBL6918319 0.86 BACE1 (0.58) BACE1BACE2
SCHEMBL6917593 0.86 BACE1 (0.58) BACE1BACE2
SCHEMBL15241666 0.85 BACE1 (0.78) BACE1BACE2
SCHEMBL15241667 0.80 BACE1 (0.41) BACE1BACE2
Elenbecestat SCHEMBL29359992 0.80 BACE1 (1.00) BACE1BACE2
Elenbecestat SCHEMBL2620149 0.80 BACE1 (1.00) BACE1BACE2
Elenbecestat SCHEMBL2933223 0.80 BACE1 (1.00) BACE1BACE2
Elenbecestat SCHEMBL30477102 0.80 BACE1 (1.00) BACE1BACE2

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-2456774-B1 FUSED AMINODIHYDRO-OXAZINE DERIVATIVES EISAI R&D MAN CO LTD (JP) 2013-09-04 EP disclosed