SCHEMBL18567441

SCHEMBL18567441

Bc1ccc(F)c(C2(C)CS(=O)(=O)C(C)(C)C(=N)N2)n1

nearest known ligand 0.40

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 14/20 0.40

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
SCHEMBL13467261 0.88 BACE1 (0.39) BACE1
SCHEMBL13466086 0.88 BACE1 (0.39) BACE1
SCHEMBL15693452 0.86 BACE1 (0.56) BACE1
SCHEMBL13467260 0.86 BACE1 (0.56) BACE1
SCHEMBL13466988 0.78 BACE1 (0.41) BACE1
SCHEMBL13467022 0.78 BACE1 (0.49) BACE1
SCHEMBL18567433 0.78 BACE1 (0.49) BACE1
SCHEMBL13466955 0.76 BACE1 (0.62) BACE1
SCHEMBL17325999 0.74 BACE1 (0.64) BACE1
SCHEMBL13466614 0.74 BACE1 (0.64) 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-2697210-B1 5-SUBSTITUTED IMINOTHIAZINES AND THEIR MONO-AND DIOXIDES AS BACE INHIBITORS, COMPOSITIONS, AND THEIR USE MERCK SHARP & DOHME (US) 2017-03-01 EP disclosed