SCHEMBL9829960

SCHEMBL9829960

CC(O)C(NC(=O)c1cc2ccccc2cc1O)C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PYGL P06737 3/20 0.54
KMT2A Q03164 7/20 0.53
MEN1 O00255 6/20 0.53
MAPT P10636 3/20 0.53
TDP1 Q9NUW8 3/20 0.53
GAA P10253 2/20 0.53
MITF O75030 1/20 0.53
NCOA1 Q15788 1/20 0.53
NCOA3 Q9Y6Q9 1/20 0.53
NPC1 O15118 4/20 0.49
RAB9A P51151 4/20 0.49
POLB P06746 2/20 0.49
KDM4E B2RXH2 2/20 0.48
ALDH1A1 P00352 1/20 0.48
CASP1 P29466 1/20 0.48
CASP7 P55210 1/20 0.48
CYP2C9 P11712 2/20 0.47
CA2 P00918 2/20 0.47
CA1 P00915 1/20 0.47
CASP3 P42574 1/20 0.47

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
SCHEMBL9829969 1.00 PYGL (0.54) PYGLKMT2AMEN1MAPTTDP1
SCHEMBL5143499 0.83 KMT2A (0.60) KMT2AMEN1MAPTTDP1GAA
SCHEMBL17404128 0.82 KDM4E (0.62) PYGLKMT2AMEN1MAPTGAA
SCHEMBL17403869 0.82 KDM4E (0.62) PYGLKMT2AMEN1MAPTGAA
SCHEMBL11310218 0.82 MEN1 (0.62) KMT2AMEN1MAPTTDP1GAA
SCHEMBL11154417 0.82 KMT2A (0.62) KMT2AMEN1MAPTTDP1GAA
SCHEMBL7031326 0.78 PLK1 (0.55) PYGLKMT2AMEN1GAANPC1
SCHEMBL15941344 0.77 CA2 (0.47) PYGLKMT2AMEN1KDM4EALDH1A1
SCHEMBL15941337 0.77 CA2 (0.47) PYGLKMT2AMEN1KDM4EALDH1A1
SCHEMBL6809242 0.77 CA2 (0.49) PYGLTDP1KDM4EALDH1A1CA2

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