SCHEMBL15225329

SCHEMBL15225329

NC1=N[C@@]2(c3cc(NC(=O)c4cnc(C(F)F)cn4)ccc3F)CO[C@H](CF)[C@H]2CO1

nearest known ligand 0.78

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 19/20 0.65
BACE2 Q9Y5Z0 11/20 0.65

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
SCHEMBL11982767 1.00 BACE1 (0.65) BACE1BACE2
SCHEMBL11967168 1.00 BACE1 (0.65) BACE1BACE2
SCHEMBL6917323 1.00 BACE1 (0.65) BACE1BACE2
SCHEMBL11967124 0.94 BACE1 (0.59) BACE1BACE2
SCHEMBL6917327 0.90 BACE1 (0.64) BACE1BACE2
SCHEMBL15241666 0.89 BACE1 (0.78) BACE1BACE2
SCHEMBL6918189 0.89 BACE1 (0.60) BACE1BACE2
SCHEMBL6917196 0.88 BACE1 (0.67) BACE1BACE2
SCHEMBL6916607 0.88 BACE1 (0.67) BACE1BACE2
SCHEMBL6917554 0.88 BACE1 (0.77) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9079914-B2 Fused aminodihydro-oxazine derivatives EISAI R&D MANAGEMENT CO., LTD. (JP) 2015-07-14 US disclosed
EP-2653473-A1 Fused Aminodihydro-Oxazine Derivatives Eisai R&D Management Co., Ltd. (JP) 2013-10-23 EP disclosed
EP-2653473-A1 Fused Aminodihydro-Oxazine Derivatives Eisai R&D Management Co., Ltd. (JP) 2013-10-23 EP disclosed
EP-2456774-B1 FUSED AMINODIHYDRO-OXAZINE DERIVATIVES EISAI R&D MAN CO LTD (JP) 2013-09-04 EP disclosed