SCHEMBL5792883

SCHEMBL5792883

NC(=O)[C@H]1CN(c2ccc([C@@H]3CC[S@@+]([O-])C(=O)C3)cc2)C(=O)O1

nearest known ligand 0.46

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MAOA P21397 2/20 0.46
F10 P00742 2/20 0.35
PARP1 P09874 1/20 0.32
FADS1 O60427 1/20 0.32
DGAT1 O75907 2/20 0.30
GRM2 Q14416 1/20 0.30

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
SCHEMBL5792480 1.00 MAOA (0.46) MAOAF10PARP1FADS1DGAT1
SCHEMBL3043386 0.86 MAOA (0.49) MAOAF10PARP1FADS1DGAT1
SCHEMBL3044472 0.86 MAOA (0.49) MAOAF10PARP1FADS1DGAT1
SCHEMBL6040387 0.86 MAOA (0.49) MAOAF10PARP1FADS1DGAT1
SCHEMBL3043385 0.86 MAOA (0.49) MAOAF10PARP1FADS1DGAT1
SCHEMBL6040388 0.86 MAOA (0.49) MAOAF10PARP1FADS1DGAT1
SCHEMBL5795260 0.83 MAOA (0.67) MAOAF10
SCHEMBL5792925 0.83 MAOA (0.67) MAOAF10
SCHEMBL5796347 0.82 MAOA (0.51) MAOA
SCHEMBL5795992 0.82 MAOA (0.51) MAOA

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
EP-1478629-B1 N-ARYL-2-OXAZOLIDINONE-5-CARBOXAMIDES AND THEIR DERIVATIVES AND THEIR USE AS ANTIBACTERIALS PHARMACIA & UPJOHN CO LLC (US) 2006-10-11 EP claimed