SCHEMBL9828908

SCHEMBL9828908

CCOC(=O)NC(CC)(C(=O)O)c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.51
GAA P10253 1/20 0.47
HPGD P15428 4/20 0.47
ALDH1A1 P00352 4/20 0.47
KMT2A Q03164 2/20 0.44
MEN1 O00255 1/20 0.44
NPC1 O15118 3/20 0.43
RAB9A P51151 2/20 0.43
CRHBP P24387 1/20 0.43
CRHR2 Q13324 1/20 0.43
THRB P10828 1/20 0.42
LMNA P02545 2/20 0.42
MAPT P10636 1/20 0.42
MAPK1 P28482 1/20 0.42
HSD17B10 Q99714 1/20 0.42
GLA P06280 1/20 0.42
POLB P06746 1/20 0.42
ATM Q13315 1/20 0.42
CXCR2 P25025 1/20 0.42
RECQL P46063 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
SCHEMBL9828915 1.00 KDM4E (0.51) KDM4EGAAHPGDALDH1A1KMT2A
SCHEMBL9830815 0.88 LMNA (0.45) KDM4EGAAHPGDALDH1A1KMT2A
SCHEMBL9830821 0.88 LMNA (0.45) KDM4EGAAHPGDALDH1A1KMT2A
SCHEMBL193093 0.87 KCNN4 (0.44) KDM4EGAAHPGDALDH1A1KMT2A
SCHEMBL5711399 0.87 MEN1 (0.51) ALDH1A1KMT2AMEN1NPC1RAB9A
SCHEMBL31329451 0.85 CXCR2 (0.39) KDM4EGAAHPGDALDH1A1KMT2A
SCHEMBL10440896 0.85 POLB (0.48) KDM4EGAAHPGDALDH1A1KMT2A
SCHEMBL4034639 0.84 ALDH1A1 (0.48) KDM4EGAAHPGDALDH1A1KMT2A
SCHEMBL6070284 0.83 KDM4E (0.45) KDM4EGAAHPGDALDH1A1KMT2A
SCHEMBL27158981 0.83 CA12 (0.43) GAAKMT2AMEN1NPC1RAB9A

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