SCHEMBL5329339

SCHEMBL5329339

CCOC(=O)c1c(O)c2cc(F)ccc2n(CCCc2ccccc2)c1=O

nearest known ligand 0.61

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.61
LMNA P02545 3/20 0.61
ALDH1A1 P00352 5/20 0.60
HTT P42858 1/20 0.59
SMN1; SMN2 Q16637 2/20 0.57
L3MBTL1 Q9Y468 2/20 0.49
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
MAPT P10636 3/20 0.48
PKM P14618 2/20 0.48
GAA P10253 1/20 0.48
RECQL P46063 1/20 0.47
TDP1 Q9NUW8 1/20 0.46

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
SCHEMBL5124064 0.88 ALDH1A1 (0.63) KDM4ELMNAALDH1A1HTTSMN1; SMN2
SCHEMBL5330384 0.82 ALDH1A1 (0.61) KDM4ELMNAALDH1A1HTTSMN1; SMN2
SCHEMBL5531254 0.81 KDM4E (0.57) KDM4ELMNAALDH1A1HTTSMN1; SMN2
SCHEMBL5332751 0.81 ALDH1A1 (0.60) KDM4ELMNAALDH1A1HTTSMN1; SMN2
SCHEMBL8244124 0.80 EGLN1 (0.59) KDM4ELMNAHTTL3MBTL1MEN1
SCHEMBL5529472 0.80 ALDH1A1 (0.69) KDM4ELMNAALDH1A1HTTSMN1; SMN2
SCHEMBL31329665 0.80 ALDH1A1 (0.69) KDM4ELMNAALDH1A1HTTSMN1; SMN2
SCHEMBL5335435 0.78 ALDH1A1 (0.57) KDM4ELMNAALDH1A1HTTSMN1; SMN2
SCHEMBL5330885 0.78 ALDH1A1 (0.56) KDM4ELMNAALDH1A1HTTSMN1; SMN2
SCHEMBL5334103 0.78 ALDH1A1 (0.57) KDM4ELMNAALDH1A1HTTSMN1; 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007038571-A2 PROLYL HYDROXYLASE ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 2007-04-05 WO disclosed