SCHEMBL6919474

SCHEMBL6919474

O=C(C=CC(=O)c1ccccc1)NCC1CN(c2ccccc2N2CCSC[C@@H]2F)C(=O)O1

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAOB P27338 4/20 0.41
MAOA P21397 2/20 0.41
F10 P00742 15/20 0.39
LMNA P02545 1/20 0.34
PTGS1 P23219 1/20 0.34
CALML3 P27482 1/20 0.34
SDHA P31040 1/20 0.34
F2 P00734 1/20 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
SCHEMBL3523278 0.83 MAOB (0.48) MAOBMAOAF10LMNAPTGS1
SCHEMBL3523281 0.83 MAOB (0.48) MAOBMAOAF10LMNAPTGS1
SCHEMBL6920376 0.78 F10 (0.41) MAOBMAOAF10LMNA
SCHEMBL3523280 0.78 MAOB (0.70) MAOBMAOAF10LMNAPTGS1
SCHEMBL3523145 0.77 MAOB (0.47) MAOBMAOAF10LMNAPTGS1
SCHEMBL3523141 0.77 MAOB (0.47) MAOBMAOAF10LMNAPTGS1
SCHEMBL6919869 0.77 MAOB (0.40) MAOBMAOAF10LMNAPTGS1
SCHEMBL6816824 0.76 F10 (0.37) MAOBMAOAF10LMNAPTGS1
SCHEMBL6918620 0.76 MAOA (0.39) MAOBMAOAF10LMNA
SCHEMBL6918839 0.75 MAOA (0.41) MAOBMAOAF10LMNAPTGS1

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-2004026848-A1 OXAZOLIDINONE DERIVATIVES, PROCESS FOR THEIR PREPERATION AND THEIR USE AS ANTIMYCOBACTERIAL AGENTS LUPIN LIMITED (IN) 2004-04-01 WO claimed