SCHEMBL25759947

SCHEMBL25759947

O=C1OC(CO)CN1c1ccc(-c2ccc(F)nc2)c(F)c1

nearest known ligand 0.76

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CALML3 P27482 6/20 0.76
CYP2C19 P33261 2/20 0.68
CYP3A4 P08684 2/20 0.68
MAOA P21397 11/20 0.67
MAOB P27338 2/20 0.67
CYP2C9 P11712 1/20 0.66
CYP2D6 P10635 1/20 0.56

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
SCHEMBL24143791 1.00 CALML3 (0.76) CALML3CYP2C19CYP3A4MAOAMAOB
SCHEMBL18786542 0.91 CALML3 (0.64) CALML3CYP2C19CYP3A4MAOAMAOB
SCHEMBL18786484 0.91 CALML3 (0.64) CALML3CYP2C19CYP3A4MAOAMAOB
SCHEMBL18787358 0.90 CALML3 (0.62) CALML3CYP2C19CYP3A4MAOAMAOB
SCHEMBL24125180 0.90 CALML3 (0.62) CALML3CYP2C19CYP3A4MAOAMAOB
SCHEMBL14839459 0.89 CALML3 (0.73) CALML3CYP2C19CYP3A4MAOAMAOB
SCHEMBL29432576 0.87 CALML3 (0.77) CALML3CYP2C19CYP3A4MAOAMAOB
SCHEMBL22245049 0.87 CALML3 (0.77) CALML3CYP2C19CYP3A4MAOAMAOB
SCHEMBL3323279 0.87 CALML3 (0.80) CALML3CYP2C19CYP3A4MAOAMAOB
SCHEMBL3323276 0.87 CALML3 (0.80) CALML3CYP2C19CYP3A4MAOAMAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023122759-A2 OXAZOLIDINONE LIPOSOME COMPOSITIONS AKAGERA MEDICINES, INC. (US) 2023-06-29 WO disclosed