SCHEMBL9830409

SCHEMBL9830409

CCOC(=O)NC(C(=O)NC(CC(C)C)C(=O)O)C(C)C

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.47
MEN1 O00255 1/20 0.45
LMNA P02545 1/20 0.45
KMT2A Q03164 1/20 0.45
MME P08473 2/20 0.44
MAPT P10636 1/20 0.43
FOLH1 Q04609 4/20 0.43
LAP3 P28838 3/20 0.42
CTSB P07858 1/20 0.41
CTSK P43235 1/20 0.41
ECE1 P42892 1/20 0.41

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
SCHEMBL9830412 1.00 ALDH1A1 (0.47) ALDH1A1MEN1LMNAKMT2AMME
SCHEMBL9830039 0.86 ALDH1A1 (0.58) ALDH1A1MEN1LMNAKMT2AMME
SCHEMBL729840 0.86 ALDH1A1 (0.58) ALDH1A1MEN1LMNAKMT2AMME
SCHEMBL9557207 0.86 ALDH1A1 (0.58) ALDH1A1MEN1LMNAKMT2AMME
SCHEMBL19787736 0.81 MME (0.44) ALDH1A1LMNAMMECTSKECE1
SCHEMBL31207145 0.81 ALDH1A1 (0.46) ALDH1A1MEN1LMNAKMT2AMME
SCHEMBL5663757 0.81 CTSS (0.58) ALDH1A1CTSBCTSK
SCHEMBL9829817 0.81 FNTA (0.46) ALDH1A1LMNA
SCHEMBL9829809 0.81 FNTA (0.46) ALDH1A1LMNA
SCHEMBL25251125 0.80 CTSK (0.65) MMECTSBCTSKECE1

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