SCHEMBL2109353

SCHEMBL2109353

NC1=NC2(c3cc(NC(=O)c4cnc(OCF)cn4)ccc3F)COC(CF)C2CS1

nearest known ligand 0.78

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 16/20 0.67
BACE2 Q9Y5Z0 14/20 0.67

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
SCHEMBL2109350 1.00 BACE1 (0.67) BACE1BACE2
SCHEMBL2109605 1.00 BACE1 (0.67) BACE1BACE2
SCHEMBL2933589 0.95 BACE1 (0.68) BACE1BACE2
SCHEMBL2620143 0.95 BACE1 (0.68) BACE1BACE2
SCHEMBL11949355 0.93 BACE1 (0.71) BACE1BACE2
SCHEMBL2926316 0.93 BACE1 (0.68) BACE1BACE2
SCHEMBL2620226 0.93 BACE1 (0.68) BACE1BACE2
SCHEMBL2108018 0.93 BACE1 (0.66) BACE1BACE2
SCHEMBL2106976 0.92 BACE1 (0.64) BACE1BACE2
SCHEMBL2926862 0.91 BACE1 (0.76) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2233474-B1 CONDENSED AMINODIHYDROTHIAZINE DERIVATIVE EISAI R&D MAN CO LTD (JP) 2015-08-05 EP disclosed
US-8158620-B2 Fused aminodihydrothiazine derivatives EISAI R&D MANAGEMENT CO., LTD. (JP) 2012-04-17 US disclosed