SCHEMBL7700862

SCHEMBL7700862

CC(C)(C)OC(=O)N(CC1CN(c2ccc(C3=CCSC(=O)C3)c(F)c2)C(=O)O1)c1ccon1

nearest known ligand 0.44

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MAOA P21397 12/20 0.44
CALML3 P27482 4/20 0.40
MAOB P27338 3/20 0.38
F10 P00742 1/20 0.36

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
SCHEMBL13298877 0.90 MAOA (0.47) MAOACALML3MAOB
SCHEMBL7699258 0.90 MAOA (0.46) MAOACALML3MAOB
SCHEMBL7699259 0.90 MAOA (0.46) MAOACALML3MAOB
SCHEMBL7700863 0.86 MAOA (0.45) MAOACALML3MAOB
SCHEMBL3325808 0.84 MAOB (0.42) MAOACALML3MAOBF10
SCHEMBL3325810 0.84 MAOB (0.42) MAOACALML3MAOBF10
SCHEMBL12964467 0.84 MAOB (0.42) MAOACALML3MAOBF10
SCHEMBL7699782 0.83 MAOA (0.37) MAOACALML3MAOBF10
SCHEMBL7699780 0.83 MAOA (0.37) MAOACALML3MAOBF10
SCHEMBL3327252 0.83 MAOB (0.41) MAOACALML3MAOBF10

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-2002081469-A1 OXAZOLIDINONE-SULFOXIMINES AND -SULFILIMINES AS ANTIBIOTICS ASTRAZENECA AB (SE) 2002-10-17 WO disclosed