SCHEMBL7624596

SCHEMBL7624596

CC1=CC(O[Si](C)(C)C)C2C(=O)c3c(O)cccc3C(=O)C2C1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 2/20 0.51
IDO1 P14902 3/20 0.38
MAOA P21397 4/20 0.34
MAOB P27338 3/20 0.34
STAT3 P40763 2/20 0.33
MEN1 O00255 4/20 0.33
KMT2A Q03164 4/20 0.33
ALDH1A1 P00352 4/20 0.33
MAPT P10636 4/20 0.33
MAPK1 P28482 4/20 0.33
TDP1 Q9NUW8 4/20 0.33
HPGD P15428 3/20 0.33
ALOX15 P16050 3/20 0.33
HSD17B10 Q99714 3/20 0.33
KDM4E B2RXH2 3/20 0.33
CYP3A4 P08684 3/20 0.33
RECQL P46063 3/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
TRPA1 O75762 2/20 0.33
TP53 P04637 2/20 0.33

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
SCHEMBL7624508 0.95 PIM1 (0.46) PIM1IDO1MAOAMAOBSTAT3
SCHEMBL7637705 0.83 PIM1 (0.51) PIM1IDO1MAOAMAOBSTAT3
SCHEMBL7633252 0.79 NSD2 (0.51) PIM1IDO1MAOAMAOBSTAT3
SCHEMBL7628574 0.65 NSD2 (0.70) PIM1IDO1MAOAMAOBSTAT3
SCHEMBL31199228 0.62 ALDH1A1 (0.47) MEN1KMT2AALDH1A1MAPTMAPK1
SCHEMBL10636266 0.62 ALDH1A1 (0.47) MEN1KMT2AALDH1A1MAPTMAPK1
SCHEMBL28137965 0.61 STAT3 (0.54) PIM1IDO1MAOAMAOBSTAT3
SCHEMBL7637697 0.60 NSD2 (0.77) PIM1IDO1MAOAMAOBSTAT3
SCHEMBL9389657 0.60 MAOA (0.54) PIM1IDO1MAOAMAOBSTAT3
SCHEMBL19860466 0.57 PIM1 (0.41) PIM1IDO1MAOAMAOBSTAT3

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
EP-0909268-B1 METHOD FOR PREPARING SUBSTITUTED ANTHRAQUINONE AND APPLICATION TO THE PREPARATION OF RHEINS GIREX (FR) 2002-06-05 EP disclosed
US-6057461-A Method for preparing substituted anthraquinone and application to the preparation of rheins GIREX (FR) 2000-05-02 US disclosed