SCHEMBL20056261

SCHEMBL20056261

Cc1nnc(-c2cc(Cl)c([C@]3(C)CS(=O)(=O)N(C)C(=N)N3)s2)o1

nearest known ligand 0.54

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 20/20 0.54
BACE2 Q9Y5Z0 20/20 0.54

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
SCHEMBL17127245 0.90 BACE1 (0.68) BACE1BACE2
SCHEMBL17149016 0.89 BACE1 (0.67) BACE1BACE2
SCHEMBL17127256 0.88 BACE1 (0.57) BACE1BACE2
SCHEMBL17127283 0.88 BACE1 (0.65) BACE1BACE2
SCHEMBL17127275 0.87 BACE1 (0.65) BACE1BACE2
SCHEMBL17127255 0.87 BACE1 (0.65) BACE1BACE2
SCHEMBL17127259 0.87 BACE1 (0.65) BACE1BACE2
SCHEMBL17127265 0.86 BACE1 (0.66) BACE1BACE2
SCHEMBL17127277 0.86 BACE1 (0.66) BACE1BACE2
SCHEMBL17127281 0.86 BACE1 (0.67) 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-2908825-B1 TRICYCLIC SUBSTITUTED THIADIAZINE DIOXIDE COMPOUNDS AS BACE INHIBITORS, COMPOSITIONS, AND THEIR USE MERCK SHARP & DOHME (US) 2018-04-18 EP disclosed