SCHEMBL6529666

SCHEMBL6529666

CN1C(=O)COc2cc(N3C[C@H](CO)OC3=O)ccc21

nearest known ligand 0.64

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
F10 P00742 3/20 0.64
MAOA P21397 4/20 0.54
MAOB P27338 4/20 0.54
CALML3 P27482 7/20 0.47
CYP11B2 P19099 2/20 0.43
CYP11B1 P15538 1/20 0.43
LMNA P02545 1/20 0.40
PTGS1 P23219 1/20 0.40
SDHA P31040 1/20 0.40
PDE3B Q13370 1/20 0.40
PDE3A Q14432 1/20 0.40
CYP3A4 P08684 1/20 0.39
CYP2C19 P33261 1/20 0.39

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
SCHEMBL6529626 0.89 F10 (0.61) F10MAOAMAOBCALML3CYP11B2
SCHEMBL6529624 0.89 F10 (0.61) F10MAOAMAOBCALML3CYP11B2
SCHEMBL8131862 0.89 F10 (0.61) F10MAOAMAOBCALML3CYP11B2
SCHEMBL8138382 0.87 MAOB (0.52) F10MAOAMAOBCALML3LMNA
SCHEMBL8140551 0.85 F10 (0.73) F10MAOAMAOBCALML3LMNA
SCHEMBL6528285 0.84 F10 (0.49) F10MAOAMAOBCALML3LMNA
SCHEMBL6528284 0.84 F10 (0.49) F10MAOAMAOBCALML3LMNA
SCHEMBL8140856 0.84 F10 (0.71) F10MAOAMAOBCALML3LMNA
SCHEMBL8145429 0.84 F10 (0.68) F10MAOAMAOBCALML3LMNA
SCHEMBL8128440 0.84 F10 (0.73) F10MAOAMAOBCALML3LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2005082897-A1 OXAZOLIDINONE ANTIBACTERIAL AGENTS PHARMACIA & UPJOHN COMPANY LLC (US) 2005-09-09 WO disclosed
EP-1049692-A1 NOVEL BICYCLENE-SUBSTITUTED OXAZOLIDINONES Bayer Aktiengesellschaft (DE) 2000-11-08 EP disclosed
WO-1999037641-A1 NOVEL BICYCLENE-SUBSTITUTED OXAZOLIDINONES BAYER AKTIENGESELLSCHAFT (DE) 1999-07-29 WO disclosed