SCHEMBL4654063

SCHEMBL4654063

CCCCC(CC)CNc1cccc2c1C(=O)c1ccccc1C2=O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.50
L3MBTL1 Q9Y468 4/20 0.50
MAPK1 P28482 4/20 0.50
SMN1; SMN2 Q16637 4/20 0.50
EGFR P00533 2/20 0.50
TDP1 Q9NUW8 2/20 0.50
PABPC1 P11940 1/20 0.50
RAB9A P51151 1/20 0.50
ALDH1A1 P00352 5/20 0.47
MEN1 O00255 4/20 0.47
KMT2A Q03164 4/20 0.47
HTT P42858 3/20 0.47
POLB P06746 2/20 0.47
RAD52 P43351 2/20 0.47
LMNA P02545 2/20 0.47
RECQL P46063 2/20 0.47
NPSR1 Q6W5P4 2/20 0.47
BLM P54132 1/20 0.47
MAOA P21397 1/20 0.46
KDM4E B2RXH2 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
SCHEMBL15603977 0.97 MAPT (0.45) MAPTL3MBTL1MAPK1SMN1; SMN2EGFR
SCHEMBL5605880 0.96 MAPT (0.44) MAPTL3MBTL1MAPK1SMN1; SMN2EGFR
SCHEMBL2339098 0.91 ALDH1A1 (0.45) MAPTL3MBTL1MAPK1TDP1RAB9A
SCHEMBL29425649 0.91 ALDH1A1 (0.45) MAPTL3MBTL1MAPK1TDP1RAB9A
SCHEMBL12267978 0.88 TERT (0.39) MAPTL3MBTL1MAPK1SMN1; SMN2EGFR
SCHEMBL15603976 0.85 MMP14 (0.40) MAPTL3MBTL1MAPK1SMN1; SMN2EGFR
SCHEMBL15604000 0.84 MAPT (0.41) MAPTL3MBTL1MAPK1SMN1; SMN2EGFR
SCHEMBL15603973 0.84 MMP14 (0.42) MAPTL3MBTL1MAPK1SMN1; SMN2EGFR
SCHEMBL1898463 0.84 MEN1 (0.46) MAPTL3MBTL1MAPK1SMN1; SMN2EGFR
SCHEMBL19135947 0.84 MEN1 (0.45) MAPTL3MBTL1MAPK1SMN1; SMN2EGFR

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1987124-A1 LIQUID WHITENING MAINTENANCE COMPOSITION UNILEVER PLC (GB) 2008-11-05 EP disclosed
EP-1984485-A1 LAUNDRY TREATMENT COMPOSITIONS UNILEVER PLC (GB) 2008-10-29 EP disclosed
WO-2007096067-A1 LIQUID WHITENING MAINTENANCE COMPOSITION UNILEVER PLC (GB) 2007-08-30 WO disclosed
WO-2007093303-A1 LAUNDRY TREATMENT COMPOSITIONS UNILEVER PLC (GB) 2007-08-23 WO disclosed