SCHEMBL9828628

SCHEMBL9828628

O=C(O)CCNC(=O)c1cc2ccccc2cc1O

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.72
KDM4E B2RXH2 3/20 0.72
ALDH1A1 P00352 2/20 0.72
CASP1 P29466 1/20 0.72
CASP7 P55210 1/20 0.72
GAA P10253 2/20 0.61
MEN1 O00255 2/20 0.61
KMT2A Q03164 2/20 0.61
MITF O75030 1/20 0.61
NCOA1 Q15788 1/20 0.61
TDP1 Q9NUW8 1/20 0.61
NCOA3 Q9Y6Q9 1/20 0.61
PTGS1 P23219 1/20 0.55
PTGS2 P35354 1/20 0.55
SIRT1 Q96EB6 1/20 0.55
NPC1 O15118 6/20 0.55
MAPK1 P28482 1/20 0.55
HPGD P15428 1/20 0.54
AKR1C3 P42330 1/20 0.54
AKR1C2 P52895 1/20 0.54

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
SCHEMBL11439147 0.89 MAPT (0.84) MAPTKDM4EALDH1A1CASP1CASP7
SCHEMBL5657979 0.88 ALDH1A1 (0.65) MAPTKDM4EALDH1A1CASP1CASP7
SCHEMBL4579542 0.84 MAPT (1.00) MAPTKDM4EALDH1A1CASP1CASP7
SCHEMBL4831515 0.84 MAPT (0.67) MAPTKDM4EALDH1A1CASP1CASP7
SCHEMBL11133405 0.83 MAPT (0.70) MAPTKDM4EALDH1A1CASP1CASP7
SCHEMBL11568743 0.83 MAPT (0.74) MAPTKDM4EALDH1A1CASP1CASP7
SCHEMBL9312831 0.83 MAPT (0.74) MAPTKDM4EALDH1A1CASP1CASP7
SCHEMBL14263560 0.82 MAPT (0.73) MAPTKDM4EALDH1A1CASP1CASP7
SCHEMBL11333817 0.81 MAPT (0.82) MAPTKDM4EALDH1A1CASP1CASP7
Hydrochloric Acid SCHEMBL10348698 0.81 MAPT (0.72) MAPTKDM4EALDH1A1CASP1CASP7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1036832-C Composition containing a penem or carbapenem artibiotic and the use of the same SANKYO CO (JP) 1997-12-31 CN claimed
EP-0226304-B1 COMPOSITION CONTAINING A PENEM OR CARBAPENEM ANTIBIOTIC SANKYO COMPANY LIMITED (JP) 1991-08-28 EP claimed
US-4757066-A Reduces renal toxicity SANKYO COMPANY LIMITED (JP) 1988-07-12 US claimed
EP-0226304-A1 Composition containing a penem or carbapenem antibiotic SANKYO COMPANY LIMITED (JP) 1987-06-24 EP claimed
CN-86107574-A Compositions containing penem or carbapenem antibiotics and their use 1987-05-20 CN claimed
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