SCHEMBL28116313

SCHEMBL28116313

CCC(=O)O[C@H]1CN(c2ccc(N3CCOCC3)c(F)c2)C(=O)O1

nearest known ligand 0.63

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAOB P27338 13/20 0.63
MAOA P21397 6/20 0.63
PTGS1 P23219 2/20 0.63
SDHA P31040 2/20 0.63
LMNA P02545 1/20 0.63
CALML3 P27482 1/20 0.63
F10 P00742 4/20 0.56
NPC1 O15118 1/20 0.46

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
SCHEMBL12006737 1.00 MAOB (0.63) MAOBMAOAPTGS1SDHALMNA
SCHEMBL27373749 0.84 MAOB (0.62) MAOBMAOAPTGS1SDHALMNA
SCHEMBL4391789 0.83 MAOB (0.57) MAOBMAOAPTGS1SDHALMNA
SCHEMBL12006612 0.83 MAOB (0.64) MAOBMAOAPTGS1SDHALMNA
SCHEMBL12006609 0.83 MAOB (0.64) MAOBMAOAPTGS1SDHALMNA
SCHEMBL4386333 0.83 MAOB (0.59) MAOBMAOAPTGS1SDHALMNA
SCHEMBL12477874 0.82 MAOB (0.66) MAOBMAOAPTGS1SDHALMNA
SCHEMBL12478361 0.82 MAOB (0.66) MAOBMAOAPTGS1SDHALMNA
SCHEMBL12006736 0.82 MAOB (0.74) MAOBMAOAPTGS1SDHALMNA
SCHEMBL27602071 0.82 MAOB (0.44) MAOBMAOAPTGS1SDHALMNA

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
CN-106279054-A Linezolid and the new preparation process of new intermediate thereof 李药业有限公司 2017-01-04 CN claimed
CN-106279054-A Linezolid and the new preparation process of new intermediate thereof 李药业有限公司 2017-01-04 CN disclosed