SCHEMBL23787705

SCHEMBL23787705

CCOCCNCCNc1cccc2c1C(=O)c1cccc(NCCN(CC)CCO)c1C2=O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TERT O14746 5/20 0.57
KMT2A Q03164 7/20 0.54
MEN1 O00255 6/20 0.54
MAPT P10636 5/20 0.54
MAPK1 P28482 5/20 0.54
ALDH1A1 P00352 4/20 0.54
BLM P54132 4/20 0.54
SMN1; SMN2 Q16637 4/20 0.54
POLB P06746 3/20 0.54
RAD52 P43351 3/20 0.54
NPSR1 Q6W5P4 3/20 0.54
LMNA P02545 3/20 0.54
RECQL P46063 3/20 0.54
HTT P42858 3/20 0.54
EGFR P00533 2/20 0.54
L3MBTL1 Q9Y468 2/20 0.54
NSD2 O96028 2/20 0.49
FGB P02675 1/20 0.49
MMP14 P50281 1/20 0.49
TOP2B Q02880 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
SCHEMBL9503729 0.80 TOP2B (0.50) TERTKMT2AMEN1MAPTMAPK1
SCHEMBL5605466 0.78 TERT (0.72) TERTKMT2AMEN1MAPTMAPK1
SCHEMBL31218598 0.75 TERT (0.71) TERTKMT2AMEN1MAPTMAPK1
SCHEMBL9364080 0.75 TERT (0.71) TERTKMT2AMEN1MAPTMAPK1
SCHEMBL3277516 0.75 TERT (0.79) TERTKMT2AMEN1MAPTMAPK1
SCHEMBL9504757 0.74 TOP2B (0.60) TERTKMT2AMEN1MAPTMAPK1
SCHEMBL13434539 0.74 TERT (0.51) TERTKMT2AMEN1MAPTMAPK1
SCHEMBL11688579 0.73 TERT (0.73) TERTKMT2AMEN1MAPTMAPK1
SCHEMBL25130469 0.73 KMT2A (0.53) TERTKMT2AMEN1MAPTMAPK1
Hydrochloric Acid SCHEMBL11691265 0.72 TERT (0.71) TERTKMT2AMEN1MAPTMAPK1

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
EP-3558235-B1 USE OF ANTHRAQUINONE DYES AND OF FLUORESCENT DYES FOR DYEING KERATIN FIBRES, DYEING PROCESS AND COMPOSITION OREAL (FR) 2021-09-08 EP disclosed