SCHEMBL7720407

SCHEMBL7720407

Cn1cccc1C1=C(Cl)C(=O)c2cccnc2C1=O

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
S100A4 P26447 5/20 0.56
CDC25B P30305 4/20 0.56
NSD2 O96028 4/20 0.44
TDP2 O95551 1/20 0.44
ABL1 P00519 1/20 0.44
PLCG1 P19174 1/20 0.44
CES1 P23141 1/20 0.44
PAX8 Q06710 1/20 0.44
RIN1 Q13671 1/20 0.44
MEN1 O00255 1/20 0.44
THRB P10828 1/20 0.44
BLM P54132 1/20 0.44
KMT2A Q03164 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
GAA P10253 1/20 0.44
PTPRC P08575 2/20 0.41
CTSL P07711 1/20 0.41
CTSS P25774 1/20 0.41
PTPN13 Q12923 1/20 0.41
PADI1 Q9ULC6 2/20 0.40

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
SCHEMBL7721594 0.74 PADI1 (0.50) S100A4CDC25BNSD2TDP2ABL1
SCHEMBL7719640 0.74 S100A4 (0.50) S100A4CDC25BNSD2TDP2ABL1
SCHEMBL31362908 0.74 S100A4 (1.00) S100A4CDC25BNSD2TDP2ABL1
SCHEMBL1612462 0.74 S100A4 (1.00) S100A4CDC25BNSD2TDP2ABL1
SCHEMBL16745449 0.73 S100A4 (0.77) S100A4CDC25BNSD2TDP2ABL1
SCHEMBL5915065 0.72 TDP2 (0.81) S100A4CDC25BNSD2TDP2ABL1
SCHEMBL7690116 0.69 S100A4 (0.69) S100A4CDC25BNSD2TDP2ABL1
SCHEMBL6294370 0.68 S100A4 (0.87) S100A4CDC25BNSD2TDP2ABL1
SCHEMBL9267635 0.68 TDP2 (0.74) S100A4CDC25BNSD2TDP2ABL1
SCHEMBL16745450 0.68 S100A4 (0.61) S100A4CDC25BNSD2TDP2ABL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6391064-B1 DYEING HAIR WITH AMINE QUINOLONE DERIVATIVES L'OREAL S.A. (FR) 2002-05-21 US claimed
EP-0984010-B1 Use in hair dyes of quinolin-5,8-diones or quinoxalin-5,8-diones condensed with substituted pyrroles, anilines or indoles OREAL (FR) 2001-06-20 EP claimed
EP-0984010-A1 Use in hair dyes of quinolin-5,8-diones or quinoxalin-5,8-diones condensed with substituted pyrroles, anilines or indoles L'OREAL (FR) 2000-03-08 EP claimed
US-6391064-B1 DYEING HAIR WITH AMINE QUINOLONE DERIVATIVES L'OREAL S.A. (FR) 2002-05-21 US disclosed
EP-0984010-B1 Use in hair dyes of quinolin-5,8-diones or quinoxalin-5,8-diones condensed with substituted pyrroles, anilines or indoles OREAL (FR) 2001-06-20 EP disclosed
EP-0984010-A1 Use in hair dyes of quinolin-5,8-diones or quinoxalin-5,8-diones condensed with substituted pyrroles, anilines or indoles L'OREAL (FR) 2000-03-08 EP disclosed