SCHEMBL27319009

SCHEMBL27319009

O=CC1OC(OCc2ccccc2)CN1c1ccc(C2CCC(=O)CC2)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 2/20 0.36
CTSL P07711 2/20 0.34
CTSB P07858 2/20 0.34
CTSK P43235 2/20 0.34
CTSV O60911 1/20 0.34
CTSS P25774 1/20 0.34
CTSC P53634 1/20 0.34
CTSF Q9UBX1 1/20 0.34
PSEN1 P49768 3/20 0.33
PSEN2 P49810 3/20 0.33
APH1B Q8WW43 3/20 0.33
NCSTN Q92542 3/20 0.33
APH1A Q96BI3 3/20 0.33
PSENEN Q9NZ42 3/20 0.33
HRH3 Q9Y5N1 1/20 0.32
HCRTR2 O43614 1/20 0.32
SRD5A1 P18405 2/20 0.31
SRD5A2 P31213 1/20 0.31
PTAFR P25105 1/20 0.31
MEN1 O00255 1/20 0.31

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
SCHEMBL27325072 0.85 LMNA (0.38) ESR2CTSLCTSBCTSKHRH3
SCHEMBL27448307 0.77 ESR2 (0.41) ESR2HRH3
SCHEMBL7314041 0.77 GRM2 (0.43) ESR2CTSLCTSBCTSKCTSV
SCHEMBL7314032 0.77 GRM2 (0.43) ESR2CTSLCTSBCTSKCTSV
SCHEMBL27310571 0.75 PDE4A (0.38) ESR2HRH3
SCHEMBL27310569 0.75 PDE4A (0.38) ESR2HRH3
SCHEMBL7753890 0.72 ESR2 (0.47) ESR2CTSLCTSBCTSKPSEN1
SCHEMBL27319008 0.69 PDE4A (0.40) ESR2
SCHEMBL7308062 0.69 GRM2 (0.50)
SCHEMBL7308070 0.69 GRM2 (0.50)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1051308-C Oxazolidin-2-one derivatives HOFFMANN LA ROCHE (CH) 2000-04-12 CN disclosed
CN-1109054-A Oxazolidin-2-one derivatives HOFFMANN LA ROCHE (CH) 1995-09-27 CN disclosed