SCHEMBL9755757

SCHEMBL9755757

O=C1c2ccccc2C(=O)c2c(O)c3c(c(O)c21)COC(C(=O)C1Cc2c(O)c4c(c(O)c2CO1)C(=O)c1ccccc1C4=O)C3

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.41
MEN1 O00255 4/20 0.41
KMT2A Q03164 4/20 0.41
ALDH1A1 P00352 4/20 0.41
MAOA P21397 3/20 0.41
DAPK1 P53355 3/20 0.41
HPGD P15428 3/20 0.41
KDM4E B2RXH2 2/20 0.41
CYP3A4 P08684 2/20 0.41
ALOX15 P16050 2/20 0.41
ALOX12 P18054 2/20 0.41
MAPK1 P28482 2/20 0.41
RECQL P46063 2/20 0.41
CYP1B1 Q16678 2/20 0.41
HSD17B10 Q99714 2/20 0.41
TTR P02766 2/20 0.41
TDP1 Q9NUW8 2/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
CYP1A1 P04798 1/20 0.41
HSPD1 P10809 1/20 0.41

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
SCHEMBL8901847 0.89 CHRM1 (0.41) MAPTMEN1KMT2AALDH1A1MAOA
SCHEMBL8901942 0.82 SMN1; SMN2 (0.41) MAPTALDH1A1KDM4ECYP3A4MAPK1
SCHEMBL9755776 0.76 MAPT (0.37) MAPTMEN1KMT2AALDH1A1MAOA
SCHEMBL31745135 0.72 MAPT (0.44) MAPTMEN1KMT2AALDH1A1MAOA
SCHEMBL11291057 0.72 MAPT (0.44) MAPTMEN1KMT2AALDH1A1MAOA
SCHEMBL497017 0.70 MAPT (0.40) MAPTMEN1KMT2AALDH1A1MAOA
SCHEMBL10789834 0.70 MAPT (0.40) MAPTMEN1KMT2AALDH1A1MAOA
SCHEMBL27321737 0.69 MEN1 (0.42) MAPTMEN1KMT2AALDH1A1MAOA
SCHEMBL899150 0.68 MEN1 (0.68) MAPTMEN1KMT2AALDH1A1MAOA
SCHEMBL10693025 0.68 MEN1 (0.53) MAPTMEN1KMT2AALDH1A1MAOA

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-1991019725-A2 HETEROCYCLIC ANTHRACYCLIONE AND ANTHRACYCLINE ANALOGS BIOCHEM PHARMA INC. (CA) 1991-12-26 WO disclosed