SCHEMBL27892048

SCHEMBL27892048

CC(C)(C)OC(=O)N1c2ccccc2Sc2cc(Br)cc(C(F)(F)F)c21

nearest known ligand 0.62

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ BCHE P06276 18/20 0.62
▸ NOX1 Q9Y5S8 1/20 0.43
▸ SLC6A3 Q01959 1/20 0.41
▸ MEN1 O00255 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ ALOX12 P18054 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ CTDSP1 Q9GZU7 1/20 0.39
▸ TDP1 Q9NUW8 1/20 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
SCHEMBL2591986 0.90 BCHE (0.47) BCHENOX1SLC6A3MEN1MAPT
SCHEMBL9933040 0.82 BCHE (0.40) BCHE
SCHEMBL2587116 0.80 BCHE (0.38) BCHEMEN1KMT2ATDP1
SCHEMBL27908977 0.79 BCHE (0.63) BCHENOX1
SCHEMBL12273366 0.76 BCHE (0.49) BCHENOX1SLC6A3MEN1MAPT
SCHEMBL12813131 0.73 BCHE (0.64) BCHENOX1SLC6A3MEN1MAPT
SCHEMBL31022783 0.73 BCHE (0.64) BCHENOX1SLC6A3MEN1MAPT
SCHEMBL2594428 0.72 BCHE (0.48) BCHEMEN1KMT2A
SCHEMBL2594780 0.72 PDK2 (0.46) BCHEMEN1MAPTKMT2ASMN1; SMN2
SCHEMBL24271572 0.72 BCHE (0.79) BCHENOX1MEN1MAPTALOX12

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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