SCHEMBL7619656

SCHEMBL7619656

CC(C)(C)OC(=O)CN1CCC(OS(C)(=O)=O)C1=O

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PLA2G10 O15496 2/20 0.43
PLA2G5 P39877 2/20 0.43
STS P08842 2/20 0.33
ACE P12821 2/20 0.33
GPR119 Q8TDV5 5/20 0.32
CASP3 P42574 1/20 0.32
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 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
SCHEMBL7619661 1.00 PLA2G10 (0.43) PLA2G10PLA2G5STSACEGPR119
SCHEMBL7622174 0.79 PLA2G10 (0.47) PLA2G10PLA2G5ACEKDM4EALDH1A1
SCHEMBL7622170 0.79 PLA2G10 (0.47) PLA2G10PLA2G5ACEKDM4EALDH1A1
SCHEMBL7617920 0.77 PLA2G10 (0.46) PLA2G10PLA2G5ACEKDM4EALDH1A1
SCHEMBL7617915 0.77 PLA2G10 (0.46) PLA2G10PLA2G5ACEKDM4EALDH1A1
SCHEMBL21519313 0.73 HRH3 (0.36) PLA2G10PLA2G5GPR119
SCHEMBL20488361 0.73 PLA2G10 (0.43) PLA2G10PLA2G5ACEKDM4E
SCHEMBL10954499 0.71 PLA2G10 (0.43) PLA2G10PLA2G5ACE
SCHEMBL10691419 0.71 PLA2G10 (0.43) PLA2G10PLA2G5ACE
SCHEMBL6282329 0.71 PLA2G10 (0.47) PLA2G10PLA2G5KDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0620225-B1 Cephalosporin derivatives BASILEA PHARMACEUTICA AG (CH) 2002-11-13 EP disclosed
US-5523400-A 3-(PYRROLIDIN-3-YLIDENE=CH-),7-((2-AMINOTHIAZOL-4-YL)HYDROX -IMINOACETYLAMINO-)-3-CEPHEM DERIVATIVES; BROAD SPECTRUM ANTIBIOTICS HOFFMANN-LA ROCHE INC. (US) 1996-06-04 US disclosed
EP-0620225-A1 Cephalosporin derivatives F. HOFFMANN-LA ROCHE AG (CH) 1994-10-19 EP disclosed