SCHEMBL6688477

SCHEMBL6688477

COC(=O)[C@H]1CN(c2cc(F)c3c(c2)CCC(=O)N3C)C(=O)O1.O=C(Cl)Cl

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAOA P21397 6/20 0.46
BACE1 P56817 1/20 0.36
BACE2 Q9Y5Z0 1/20 0.36
F10 P00742 5/20 0.32
CYP11B1 P15538 1/20 0.32
CYP11B2 P19099 1/20 0.32
MAOB P27338 2/20 0.31
LMNA P02545 1/20 0.31
PTGS1 P23219 1/20 0.31
CALML3 P27482 1/20 0.31
SDHA P31040 1/20 0.31
TRPV1 Q8NER1 1/20 0.31

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
SCHEMBL3046132 0.97 MAOA (0.48) MAOABACE1BACE2F10CYP11B1
SCHEMBL3041174 0.97 MAOA (0.48) MAOABACE1BACE2F10CYP11B1
SCHEMBL6671426 0.93 MAOA (0.55) MAOABACE1BACE2F10CYP11B1
SCHEMBL6671430 0.93 MAOA (0.55) MAOABACE1BACE2F10CYP11B1
SCHEMBL5999012 0.89 MAOA (0.50) MAOABACE1BACE2F10MAOB
SCHEMBL3035482 0.86 MAOA (0.59) MAOAF10CYP11B1CYP11B2MAOB
SCHEMBL3039436 0.85 MAOA (0.46) MAOAF10CYP11B1CYP11B2MAOB
SCHEMBL3830925 0.84 MAOA (0.49) MAOABACE1BACE2F10MAOB
SCHEMBL3830928 0.84 MAOA (0.49) MAOABACE1BACE2F10MAOB
SCHEMBL27602211 0.79 MAOA (0.39) MAOACYP11B1CYP11B2MAOBLMNA

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-1478629-A1 N-ARYL-2-OXAZOLIDINONE-5-CARBOXAMIDES AND THEIR DERIVATIVES AND THEIR USE AS ANTIBACTERIALS PHARMACIA & UPJOHN COMPANY (US) 2004-11-24 EP disclosed
WO-2003072553-A1 N-ARYL-2-OXAZOLIDINONE-5-CARBOXAMIDES AND THEIR DERIVATES AND THEIR USE AS ANTIBACTERIALS PHARMACIA & UPJOHN COMPANY (US) 2003-09-04 WO disclosed