SCHEMBL6607708

SCHEMBL6607708

O=C1O[C@@H](COc2cccnn2)CN1c1ccc(C2=CCOCC2)c(F)c1

nearest known ligand 0.46

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MAOA P21397 15/20 0.46
CALML3 P27482 3/20 0.44
CYP3A4 P08684 2/20 0.43
CYP2D6 P10635 1/20 0.43
MAOB P27338 2/20 0.40

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
SCHEMBL6606974 0.90 MAOA (0.46) MAOACALML3CYP3A4CYP2D6MAOB
SCHEMBL6607943 0.87 MAOA (0.49) MAOACALML3MAOB
SCHEMBL6609507 0.86 MAOA (0.47) MAOACALML3
SCHEMBL6609145 0.86 CALML3 (0.49) MAOACALML3CYP3A4CYP2D6MAOB
SCHEMBL6607909 0.86 CALML3 (0.49) MAOACALML3CYP3A4CYP2D6MAOB
SCHEMBL6609246 0.85 MAOA (0.46) MAOACALML3
SCHEMBL6607503 0.85 CALML3 (0.47) MAOACALML3CYP3A4CYP2D6
SCHEMBL6609091 0.85 CYP3A4 (0.49) MAOACALML3CYP3A4CYP2D6MAOB
SCHEMBL7082522 0.85 MAOA (0.45) MAOACALML3MAOB
SCHEMBL6607500 0.85 CALML3 (0.54) MAOACALML3CYP3A4CYP2D6MAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1082322-B1 OXAZOLIDINONE DERIVATIVES AS ANTIBIOTIC COMPOUNDS, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM ASTRAZENECA AB (SE) 2004-01-28 EP claimed
EP-1082322-A2 OXAZOLIDINONE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AstraZeneca AB (SE) 2001-03-14 EP claimed
WO-1999064416-A2 OXAZOLIDINONE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM ASTRAZENECA AB (SE) 1999-12-16 WO claimed
EP-1082322-B1 OXAZOLIDINONE DERIVATIVES AS ANTIBIOTIC COMPOUNDS, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM ASTRAZENECA AB (SE) 2004-01-28 EP disclosed
EP-1357122-A2 Oxazolidinone compounds and pharmaceutical compositions containing them AstraZeneca AB (SE) 2003-10-29 EP disclosed
EP-1082322-A2 OXAZOLIDINONE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AstraZeneca AB (SE) 2001-03-14 EP disclosed
WO-1999064416-A2 OXAZOLIDINONE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM ASTRAZENECA AB (SE) 1999-12-16 WO disclosed