SCHEMBL7216260

SCHEMBL7216260

C[SiH](C)OC1[C@@H](C(C)(C)C)CCN1c1ccc(N2C[C@H](CO)OC2=O)cc1F

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CALML3 P27482 7/20 0.48
MAOB P27338 11/20 0.45
MAOA P21397 7/20 0.45
LMNA P02545 1/20 0.45
PTGS1 P23219 1/20 0.45
SDHA P31040 1/20 0.45
CYP2C19 P33261 2/20 0.42
CYP2C9 P11712 1/20 0.42
CYP3A4 P08684 1/20 0.42

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
SCHEMBL7082695 1.00 CALML3 (0.48) CALML3MAOBMAOALMNAPTGS1
SCHEMBL7083458 0.92 CALML3 (0.50) CALML3MAOBMAOALMNAPTGS1
SCHEMBL7083450 0.92 CALML3 (0.50) CALML3MAOBMAOALMNAPTGS1
SCHEMBL7081672 0.84 MAOA (0.41) CALML3MAOBMAOALMNAPTGS1
SCHEMBL7081679 0.84 MAOA (0.41) CALML3MAOBMAOALMNAPTGS1
SCHEMBL7081132 0.76 MAOA (0.41) CALML3MAOBMAOALMNAPTGS1
SCHEMBL7081137 0.76 MAOA (0.41) CALML3MAOBMAOALMNAPTGS1
SCHEMBL7807712 0.76 CALML3 (0.51) CALML3MAOBMAOALMNAPTGS1
SCHEMBL7807715 0.76 CALML3 (0.51) CALML3MAOBMAOALMNAPTGS1
SCHEMBL7807718 0.76 CALML3 (0.51) CALML3MAOBMAOALMNAPTGS1

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
US-6617339-B1 5-Isoxazolyloxymethyl-3-((dihydroxypropanoyl)-4-tetrahydropyri dyl-3,5- difluorophenyl)oxazolidinone, or the phosphated derivative or its disodium salt; antibiotic with useful activity against Grampositive pathogens SYNGENTA LIMITED (GB) 2003-09-09 US disclosed