SCHEMBL7635167

SCHEMBL7635167

O=C1c2ncccc2-c2nccc3c2c1nc1ccccc13

nearest known ligand 0.80

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TOP2A P11388 3/20 0.80
TERT O14746 1/20 0.53
MAOA P21397 2/20 0.47
MEN1 O00255 1/20 0.46
THRB P10828 1/20 0.46
BLM P54132 1/20 0.46
KMT2A Q03164 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
PTPRC P08575 2/20 0.45
CTSL P07711 1/20 0.42
CTSS P25774 1/20 0.42
PTPN13 Q12923 1/20 0.42
TDP2 O95551 1/20 0.42
NSD2 O96028 1/20 0.42
ABL1 P00519 1/20 0.42
PLCG1 P19174 1/20 0.42
CES1 P23141 1/20 0.42
PAX8 Q06710 1/20 0.42
RIN1 Q13671 1/20 0.42
GAA P10253 1/20 0.42

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
SCHEMBL7186247 0.94 TOP2A (0.75) TOP2ATERTMAOAMEN1THRB
Ascididemin SCHEMBL6841381 0.89 TOP2A (1.00) TOP2ATERTMAOAMEN1THRB
Ascididemin SCHEMBL30547678 0.89 TOP2A (1.00) TOP2ATERTMAOAMEN1THRB
Benzosampangine SCHEMBL29601408 0.88 TOP2A (0.79) TOP2ATERTMAOAPTPRCCTSL
Benzosampangine SCHEMBL20259217 0.88 TOP2A (0.79) TOP2ATERTMAOAPTPRCCTSL
SCHEMBL6845499 0.84 TOP2A (0.57) TOP2ATERTMAOAMEN1THRB
SCHEMBL6845596 0.83 TOP2A (0.56) TOP2ATERTMAOAMEN1THRB
SCHEMBL20259026 0.80 TOP2A (0.66) TOP2ATERTMAOACDC25BALDH1A1
SCHEMBL16072069 0.79 TOP2A (0.51) TOP2AMAOAMEN1THRBBLM
SCHEMBL7184746 0.79 TOP2A (0.57) TOP2ATERTMAOAKMT2AALDH1A1

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-1202992-A2 ASCIDIDEMIN DERIVATIVES AND THEIR THERAPEUTIC APPLICATIONS LABORATOIRE L. LAFON (FR) 2002-05-08 EP claimed
WO-2001012631-A2 ASCIDIDEMIN DERIVATIVES AND THEIR THERAPEUTIC APPLICATIONS LABORATOIRE L. LAFON (FR) 2001-02-22 WO claimed