SCHEMBL27908977

SCHEMBL27908977

CC(C)(C)OC(=O)N1c2ccccc2Sc2ccc(Br)c(C(F)(F)F)c21

nearest known ligand 0.63

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ BCHE P06276 19/20 0.63
▸ NOX1 Q9Y5S8 1/20 0.44
▸ ACHE P22303 2/20 0.39

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
SCHEMBL27892001 0.82 BCHE (0.57) BCHENOX1
SCHEMBL27892048 0.79 BCHE (0.62) BCHENOX1
SCHEMBL27908969 0.76 BCHE (0.49) BCHENOX1
SCHEMBL24271572 0.72 BCHE (0.79) BCHENOX1
SCHEMBL19939632 0.71 BCHE (0.75) BCHENOX1
SCHEMBL19939631 0.69 BCHE (0.71) BCHENOX1
SCHEMBL2591986 0.69 BCHE (0.47) BCHENOX1
SCHEMBL19939626 0.68 BCHE (0.70) BCHE
SCHEMBL2762804 0.68 BCHE (0.74) BCHENOX1
SCHEMBL12813131 0.67 BCHE (0.64) BCHENOX1

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
CN-102958525-A Antiviral compounds PROSTETTA ANTIVIRAL INC 2013-03-06 — — CN disclosed
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