SCHEMBL16686182

SCHEMBL16686182

O=C1OC(CI)CN1c1c(F)cc(Br)cc1F

nearest known ligand 0.38

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAOA P21397 4/20 0.38
CALML3 P27482 6/20 0.37
GRM2 Q14416 4/20 0.36
MAOB P27338 7/20 0.35
LMNA P02545 1/20 0.35
PTGS1 P23219 1/20 0.35
SDHA P31040 1/20 0.35
F10 P00742 3/20 0.33

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
SCHEMBL16686180 1.00 MAOA (0.38) MAOACALML3GRM2MAOBLMNA
SCHEMBL16685846 0.86 CALML3 (0.50) MAOACALML3GRM2MAOB
SCHEMBL16685849 0.86 CALML3 (0.50) MAOACALML3GRM2MAOB
SCHEMBL16686176 0.82 GRM2 (0.44) MAOACALML3GRM2MAOBLMNA
SCHEMBL16686174 0.82 GRM2 (0.44) MAOACALML3GRM2MAOBLMNA
SCHEMBL16686245 0.77 CALML3 (0.50) MAOACALML3GRM2MAOBLMNA
SCHEMBL16686244 0.77 CALML3 (0.50) MAOACALML3GRM2MAOBLMNA
SCHEMBL16686236 0.75 GRM2 (0.50) GRM2F10
SCHEMBL16686237 0.75 GRM2 (0.50) GRM2F10
SCHEMBL8594735 0.75 GRM2 (0.48) MAOACALML3GRM2MAOBLMNA

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-2015066413-A1 OXAZOLIDINONE HYDROXAMIC ACID COMPOUNDS FOR THE TREATMENT OF BACTERIAL INFECTIONS NOVARTIS AG (CH) 2015-05-07 WO disclosed