SCHEMBL19235673

SCHEMBL19235673

CC(C)(C)c1cccc(C/N=C2\CS(=O)(=O)C[C@@H](Cc3ccc(O)c(Br)c3)[C@@H]2O)c1

nearest known ligand 0.60

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ BACE1 P56817 20/20 0.60
▸ CTSD P07339 16/20 0.60

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
SCHEMBL25916086 0.75 BACE1 (1.00) BACE1CTSD
SCHEMBL2910973 0.60 BACE1 (0.43) BACE1CTSD
SCHEMBL29560345 0.57 ALOX15 (0.66) —
SCHEMBL376840 0.57 ALOX15 (0.66) —
SCHEMBL506396 0.56 ACHE (0.43) BACE1
SCHEMBL16302768 0.56 CA1 (0.52) BACE1CTSD
SCHEMBL16378743 0.55 GRIN2B (0.65) —
SCHEMBL2906765 0.55 MIF (0.49) BACE1
SCHEMBL13649201 0.55 THRA (0.38) BACE1CTSD
SCHEMBL1438878 0.55 TRPA1 (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
WO-2017133517-A1 PHOSPHAMIDE DERIVATIVE, METHOD FOR MANUFACTURING THE SAME, AND USES THEREOF 四川海思科制药有限公司 2017-08-10 — — WO disclosed
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