SCHEMBL7845157

SCHEMBL7845157

CC(=O)OC[C@H]1CN(c2cc(F)c(C3=CC(Cc4ccccc4)NCC3)c(F)c2)C(=O)O1

nearest known ligand 0.41

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 15/20 0.41
MAOA P21397 2/20 0.36
CALML3 P27482 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
SCHEMBL7470390 0.87 CALML3 (0.48) GRM2MAOACALML3
SCHEMBL7140238 0.87 GRM2 (0.41) GRM2CALML3
SCHEMBL7466925 0.83 GRM2 (0.39) GRM2MAOA
Hydrochloric Acid SCHEMBL5833975 0.79 MAOA (0.41) MAOACALML3
SCHEMBL5834101 0.78 GRM2 (0.40) GRM2MAOACALML3
SCHEMBL5834105 0.78 GRM2 (0.40) GRM2MAOACALML3
SCHEMBL7000748 0.78 CALML3 (0.42) GRM2MAOACALML3
SCHEMBL7833770 0.77 CALML3 (0.58) GRM2MAOACALML3
SCHEMBL7833935 0.77 MAOA (0.34) GRM2MAOA
SCHEMBL17769267 0.73 GRM2 (0.47) GRM2MAOACALML3

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1121358-A1 HETEROCYCLYLAMINOMETHYLOXAZOLIDINONES AS ANTIBACTERIALS AstraZeneca AB (SE) 2001-08-08 EP disclosed
WO-2000021960-A1 HETEROCYCLYL AMINO METHYLOXA ZOLIDINONES AS ANTIBACTERIALS ASTRAZENECA AB (SE) 2000-04-20 WO disclosed