SCHEMBL7160657

SCHEMBL7160657

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

nearest known ligand 0.55

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAOA P21397 6/20 0.55
MAOB P27338 4/20 0.55
F10 P00742 11/20 0.49
LMNA P02545 1/20 0.43
PTGS1 P23219 1/20 0.43
CALML3 P27482 1/20 0.43
SDHA P31040 1/20 0.43

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
SCHEMBL7160662 1.00 MAOA (0.55) MAOAMAOBF10LMNAPTGS1
SCHEMBL6040266 0.90 MAOA (0.62) MAOAMAOBF10LMNAPTGS1
SCHEMBL6040269 0.90 MAOA (0.62) MAOAMAOBF10LMNAPTGS1
SCHEMBL7160687 0.89 MAOB (0.72) MAOAMAOBF10LMNAPTGS1
SCHEMBL7160682 0.89 MAOB (0.72) MAOAMAOBF10LMNAPTGS1
SCHEMBL7156705 0.88 MAOA (0.58) MAOAMAOBF10LMNAPTGS1
SCHEMBL7950981 0.88 MAOA (0.56) MAOAMAOBF10LMNAPTGS1
SCHEMBL7156288 0.88 MAOA (0.56) MAOAMAOBF10LMNAPTGS1
SCHEMBL7156291 0.88 MAOA (0.56) MAOAMAOBF10LMNAPTGS1
SCHEMBL7950978 0.88 MAOA (0.56) 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