SCHEMBL9754618

SCHEMBL9754618

CCOP(=O)(O)c1ccc(-c2cccc3ccccc23)[nH]c1=O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.41
HPGD P15428 4/20 0.41
LMNA P02545 2/20 0.41
ALDH1A1 P00352 5/20 0.39
MAPT P10636 2/20 0.39
NPSR1 Q6W5P4 2/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
GAA P10253 3/20 0.38
ALPL P05186 1/20 0.38
GSK3B P49841 1/20 0.38
ADK P55263 1/20 0.38
GLA P06280 2/20 0.36
HTT P42858 1/20 0.36
PDE10A Q9Y233 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
NR1I2 O75469 1/20 0.36
THRB P10828 1/20 0.35
CSNK1D P48730 1/20 0.35
TYMP P19971 1/20 0.35

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
SCHEMBL9534290 0.82 KDM4E (0.45) KDM4EL3MBTL1GAAALPLGSK3B
SCHEMBL9534012 0.80 KDM4E (0.43) KDM4EL3MBTL1GAAALPLGSK3B
SCHEMBL17223272 0.79 ALDH1A1 (0.49) KDM4EHPGDLMNAALDH1A1MAPT
SCHEMBL9149933 0.78 ALDH1A1 (0.36) KDM4EHPGDLMNAALDH1A1MAPT
SCHEMBL12229775 0.76 HPGD (0.54) KDM4EHPGDLMNAALDH1A1L3MBTL1
SCHEMBL9536899 0.71 CDC25B (0.42) KDM4EHPGDALDH1A1MAPTNPSR1
SCHEMBL17489008 0.70 ALDH1A1 (0.59) LMNAALDH1A1NPSR1MEN1KMT2A
SCHEMBL17537482 0.70 ALDH1A1 (0.59) LMNAALDH1A1NPSR1MEN1KMT2A
SCHEMBL9534911 0.69 ALDH1A1 (0.40) KDM4EHPGDLMNAALDH1A1MAPT
SCHEMBL9535021 0.69 GSK3B (0.47) KDM4EHPGDALDH1A1MAPTGAA

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-1991017987-A1 PHENOL AND PYRIDINOL DERIVATIVES AS PHARMACEUTICALS SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) 1991-11-28 WO disclosed