SCHEMBL9829508

SCHEMBL9829508

CCOC(=O)NC(C(=O)O)C(C)(C)OC

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.38
LMNA P02545 3/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
HTT P42858 2/20 0.37
KDM4E B2RXH2 2/20 0.35
MAPK1 P28482 2/20 0.34
GAA P10253 3/20 0.33
MGAM O43451 1/20 0.33
SI P14410 1/20 0.33
MGAM2 Q2M2H8 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
KMT2A Q03164 2/20 0.33
GLA P06280 1/20 0.33
MAPT P10636 1/20 0.33
HSD17B10 Q99714 1/20 0.33
MEN1 O00255 1/20 0.33
MMP8 P22894 1/20 0.33
MBOAT4 Q96T53 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
SCHEMBL9829512 1.00 ATM (0.38) ATMLMNASMN1; SMN2HTTKDM4E
SCHEMBL8300168 0.84 ATM (0.41) ATMLMNASMN1; SMN2HTTMAPK1
SCHEMBL204757 0.83 MEN1 (0.33) GAAKMT2AMEN1
SCHEMBL1985522 0.83 MEN1 (0.33) GAAKMT2AMEN1
SCHEMBL1982287 0.79 MEN1 (0.45) ATMGAAKMT2AHSD17B10MEN1
SCHEMBL2533499 0.79 MEN1 (0.45) ATMGAAKMT2AHSD17B10MEN1
SCHEMBL206181 0.79 MEN1 (0.45) ATMGAAKMT2AHSD17B10MEN1
SCHEMBL16070089 0.76 MEN1 (0.42) ATMGAAKMT2AHSD17B10MEN1
SCHEMBL6438885 0.76 LMNA (0.38) ATMLMNASMN1; SMN2HTTKDM4E
SCHEMBL6438887 0.76 LMNA (0.38) ATMLMNASMN1; SMN2HTTKDM4E

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-0226304-B1 COMPOSITION CONTAINING A PENEM OR CARBAPENEM ANTIBIOTIC SANKYO COMPANY LIMITED (JP) 1991-08-28 EP disclosed
US-4757066-A Reduces renal toxicity SANKYO COMPANY LIMITED (JP) 1988-07-12 US disclosed
EP-0226304-A1 Composition containing a penem or carbapenem antibiotic SANKYO COMPANY LIMITED (JP) 1987-06-24 EP disclosed