SCHEMBL8552392

SCHEMBL8552392

CC1C(CCC(=O)N2CCC(OC(=O)O)CC2)OC(=O)N1N1CCN(c2ccnnc2)CC1

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ADAMTS5 Q9UNA0 7/20 0.35
ADAMTS4 O75173 1/20 0.33
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
MAPT P10636 1/20 0.33
HIF1A Q16665 1/20 0.33
HRH3 Q9Y5N1 2/20 0.31
MMP2 P08253 1/20 0.30
ITGB3 P05106 1/20 0.30
ITGA2B P08514 1/20 0.30

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
SCHEMBL8355447 0.90 POLB (0.38) ADAMTS5ADAMTS4KDM4EALDH1A1MAPT
SCHEMBL8554007 0.77 HRH3 (0.42) HRH3ITGB3ITGA2B
SCHEMBL8552905 0.71 SIGMAR1 (0.33)
SCHEMBL8595580 0.71 HTR7 (0.34) HRH3
SCHEMBL8551745 0.69 HRH3 (0.36) HRH3ITGB3ITGA2B
SCHEMBL8776264 0.68 ALDH1A1 (0.46) ADAMTS5ADAMTS4KDM4EALDH1A1MAPT
SCHEMBL8352452 0.67 ITGB3 (0.39) HRH3ITGB3ITGA2B
SCHEMBL7790314 0.66 ALDH1A1 (0.47) ADAMTS5ADAMTS4KDM4EALDH1A1MAPT
SCHEMBL8550693 0.66 HTR2B (0.43) HRH3ITGB3ITGA2B
SCHEMBL7790836 0.66 ITGB3 (0.46) KDM4EALDH1A1MAPTHIF1AITGB3

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
EP-0839147-A1 NEW OXAZOLIDINONE DERIVATIVES, PROCESS FOR PREPARING THE SAME AND MEDICAMENTS THAT CONTAIN THESE COMPOUNDS Roche Diagnostics GmbH (DE) 1998-05-06 EP disclosed
WO-1997003072-A1 NEW OXAZOLIDINONE DERIVATIVES, PROCESS FOR PREPARING THE SAME AND MEDICAMENTS THAT CONTAIN THESE COMPOUNDS BOEHRINGER MANNHEIM GMBH (DE) 1997-01-30 WO disclosed