SCHEMBL9701411

SCHEMBL9701411

CCc1c(O)c(=O)ccn1CC(=O)O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.46
TP53 P04637 1/20 0.46
CYP2D6 P10635 1/20 0.46
HTT P42858 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
KDM6A O15550 1/20 0.41
KDM4A O75164 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
KDM5C P41229 1/20 0.41
KDM2B Q8NHM5 1/20 0.41
DOHH Q9BU89 1/20 0.41
KDM2A Q9Y2K7 1/20 0.41
KMT2A Q03164 2/20 0.40
ALDH1A1 P00352 2/20 0.40
MAPT P10636 2/20 0.40
POLB P06746 1/20 0.40
MAOB P27338 5/20 0.39
COMT P21964 2/20 0.39
MEN1 O00255 1/20 0.38

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
SCHEMBL5512663 0.84 MAPT (0.44) KDM4ETP53CYP2D6HTTSMN1; SMN2
SCHEMBL3083137 0.83 KDM4E (0.61) KDM4ETP53CYP2D6HTTSMN1; SMN2
SCHEMBL868431 0.82 KDM4E (0.47) KDM4ETP53CYP2D6HTTSMN1; SMN2
SCHEMBL5515462 0.79 KDM4E (0.47) KDM4ETP53CYP2D6HTTSMN1; SMN2
SCHEMBL10480769 0.79 KDM4E (0.42) KDM4ETP53CYP2D6HTTSMN1; SMN2
SCHEMBL4754379 0.78 KDM4E (0.46) KDM4ETP53CYP2D6HTTSMN1; SMN2
SCHEMBL9698993 0.77 KDM4E (0.46) KDM4ETP53CYP2D6HTTSMN1; SMN2
SCHEMBL31041855 0.77 KDM4E (0.44) KDM4ETP53CYP2D6HTTSMN1; SMN2
SCHEMBL17285305 0.77 KDM4E (0.44) KDM4ETP53CYP2D6HTTSMN1; SMN2
SCHEMBL6198190 0.76 ALDH1A1 (0.44) KDM4ETP53CYP2D6HTTSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1992012131-A1 3-HYDROXYPYRIDIN-4-ONE DERIVATIVES AS PHARMACEUTICAL COMPOSITIONS BRITISH TECHNOLOGY GROUP LIMITED (GB) 1992-07-23 WO disclosed
EP-0494754-A1 3-hydroxypyridin-4-one derivatives as pharmaceutical compositions BRITISH TECHNOLOGY GROUP LTD (GB) 1992-07-15 EP disclosed