SCHEMBL10697401

SCHEMBL10697401

CC(=O)Oc1c(O)cccc1[C]=O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.42
HSD17B10 Q99714 2/20 0.42
HTT P42858 2/20 0.42
GAA P10253 2/20 0.42
MAPT P10636 2/20 0.42
TP53 P04637 1/20 0.42
ALDH1A1 P00352 2/20 0.41
MAPK1 P28482 1/20 0.41
HPGD P15428 1/20 0.41
CYP3A4 P08684 1/20 0.41
THRB P10828 1/20 0.39
PREP P48147 2/20 0.39
CELA1 Q9UNI1 1/20 0.39
CA1 P00915 2/20 0.37
CA2 P00918 2/20 0.37
CA12 O43570 1/20 0.37
CA7 P43166 1/20 0.37
CA9 Q16790 1/20 0.37
CA14 Q9ULX7 1/20 0.37
LMNA P02545 2/20 0.37

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
SCHEMBL7093557 0.82 KDM4E (0.52) KDM4EHSD17B10HTTGAAMAPT
SCHEMBL812108 0.82 MAPK1 (0.57) KDM4EHSD17B10HTTGAAMAPT
SCHEMBL11477096 0.81 KDM4E (0.40) KDM4EHSD17B10HTTGAAMAPT
SCHEMBL6331609 0.79 CA1 (0.52) KDM4EHSD17B10MAPTTP53ALDH1A1
SCHEMBL10808312 0.76 MAPK1 (0.62) KDM4EHSD17B10HTTGAAMAPT
SCHEMBL2047863 0.76 KDM4E (0.62) KDM4EHSD17B10HTTGAAMAPT
SCHEMBL10697403 0.75 MAPK1 (0.45) KDM4EHSD17B10GAAMAPTALDH1A1
SCHEMBL24436699 0.74 KDM4E (0.45) KDM4EHSD17B10HTTGAAMAPT
SCHEMBL3137273 0.74 PREP (0.50) KDM4EHSD17B10HTTGAAMAPT
SCHEMBL10935928 0.73 ELANE (0.51) KDM4EHSD17B10HTTGAAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0265185-A2 Cephalosporins, processes for their preparation and pharmaceutical compositions containing them BEECHAM GROUP PLC (GB) 1988-04-27 EP disclosed