SCHEMBL21246962

SCHEMBL21246962

BrCCCC1CNCCS1

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.30
MAOB P27338 1/20 0.30

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
SCHEMBL6577243 0.80 MAOA (0.43) MAOAMAOB
SCHEMBL21056397 0.80 MAOA (0.30) MAOAMAOB
SCHEMBL28092827 0.80 MAOA (0.30) MAOAMAOB
SCHEMBL1639951 0.78 MAOA (0.42) MAOAMAOB
SCHEMBL7297284 0.77 MAOA (0.41) MAOAMAOB
SCHEMBL7287810 0.77 HLCS (0.34)
Hydrochloric Acid SCHEMBL28794459 0.76 MAOA (0.40) MAOAMAOB
SCHEMBL1099274 0.75
SCHEMBL15809194 0.75
SCHEMBL10901450 0.75

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-2019154133-A1 DIOXAZOLINE COMPOUND, PREPARATION METHOD THEREFOR, AND USES THEREOF 北京赛特明强医药科技有限公司 2019-08-15 WO disclosed