SCHEMBL585129

SCHEMBL585129

CC(C)(C)OC(=O)[N+]1(CO)CCC(O)CC1

nearest known ligand 0.40

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 1/20 0.40
CHRM1 P11229 1/20 0.40
CHRM3 P20309 1/20 0.40
NR1H2 P55055 1/20 0.34
HPGD P15428 1/20 0.33
RECQL P46063 1/20 0.32

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
SCHEMBL7477261 0.82 CTSK (0.32) NR1H2HPGD
SCHEMBL2439447 0.82 CTSK (0.32) NR1H2HPGD
SCHEMBL1296518 0.80 HPGD (0.33) NR1H2HPGD
SCHEMBL27457847 0.80 CHRM2 (0.38) CHRM2CHRM1CHRM3
SCHEMBL27459045 0.77 CHRM2 (0.43) CHRM2CHRM1CHRM3NR1H2HPGD
SCHEMBL4040718 0.73 NR1H2 (0.30) NR1H2
SCHEMBL6673776 0.68 CHRM2 (0.36) CHRM2CHRM1CHRM3
SCHEMBL14122608 0.68 CHRM2 (0.39) CHRM2CHRM1CHRM3
SCHEMBL7603453 0.66 EPHX1 (0.31)
SCHEMBL1786719 0.64 EPHX1 (0.30)

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
EP-2102217-B1 4- (2-OXO-OXAZOLIDIN-3YL)-PHENOXYMETHYLE DERIVATIVEAS AS ANTIBACTERIALS ACTELION PHARMACEUTICALS LTD (CH) 2012-02-15 EP disclosed