SCHEMBL7156702

SCHEMBL7156702

COC(=S)NC[C@H]1CN(c2cc(F)c(N3CCCSCC3)c(F)c2)C(=O)O1

nearest known ligand 0.58

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAOA P21397 5/20 0.58
MAOB P27338 4/20 0.58
F10 P00742 12/20 0.51
LMNA P02545 1/20 0.46
PTGS1 P23219 1/20 0.46
CALML3 P27482 1/20 0.46
SDHA P31040 1/20 0.46

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
SCHEMBL7156705 1.00 MAOA (0.58) MAOAMAOBF10LMNAPTGS1
SCHEMBL7709926 0.96 MAOB (0.62) MAOAMAOBF10LMNAPTGS1
SCHEMBL7709923 0.96 MAOB (0.62) MAOAMAOBF10LMNAPTGS1
SCHEMBL7160584 0.92 MAOA (0.56) MAOAMAOBF10LMNAPTGS1
SCHEMBL7160582 0.92 MAOA (0.56) MAOAMAOBF10LMNAPTGS1
SCHEMBL7161505 0.91 MAOB (0.57) MAOAMAOBF10LMNAPTGS1
SCHEMBL7161507 0.91 MAOB (0.57) MAOAMAOBF10LMNAPTGS1
SCHEMBL6040269 0.91 MAOA (0.62) MAOAMAOBF10LMNAPTGS1
SCHEMBL6040266 0.91 MAOA (0.62) MAOAMAOBF10LMNAPTGS1
SCHEMBL24169285 0.90 MAOA (0.59) MAOAMAOBF10LMNAPTGS1

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
US-6537986-B2 With thiourea, thioamide, or dithiocarbamate functionality; (S)-N-(((3-(3-fluoro-4-morpholinyl)phenyl)-2-oxo-5 -oxazolidinyl)methyl)thioacetamide for example; treats multiple-resistant staphylococci PHARMACIA & UPJOHN COMPANY 2003-03-25 US claimed