SCHEMBL7719612

SCHEMBL7719612

Cc1c(C2=CC(=O)c3ncccc3C2=O)c2ccccc2n1C

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
S100A4 P26447 3/20 0.44
ALDH1A1 P00352 2/20 0.41
MEN1 O00255 1/20 0.41
GUCY1B2 O75343 1/20 0.41
MAPT P10636 1/20 0.41
GUCY1A2 P33402 1/20 0.41
GUCY1A1 Q02108 1/20 0.41
GUCY1B1 Q02153 1/20 0.41
KMT2A Q03164 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
NTRK1 P04629 3/20 0.41
GAA P10253 2/20 0.41
KDM4E B2RXH2 1/20 0.41
GLA P06280 1/20 0.41
HPGD P15428 1/20 0.41
CYP2C19 P33261 1/20 0.41
HTT P42858 1/20 0.41
HSD17B10 Q99714 1/20 0.41
PTPRC P08575 2/20 0.39

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
SCHEMBL9562520 0.83 NTRK1 (0.51) ALDH1A1MEN1MAPTKMT2ASMN1; SMN2
SCHEMBL8992258 0.78 PTPRC (0.58) ALDH1A1NTRK1GAAKDM4EGLA
SCHEMBL7716530 0.78 PTPRC (0.62) S100A4ALDH1A1MEN1GUCY1B2MAPT
SCHEMBL7716546 0.76 CCR6 (0.53) S100A4ALDH1A1MEN1GUCY1B2MAPT
SCHEMBL9562391 0.70 NTRK1 (0.54) ALDH1A1MEN1MAPTKMT2ASMN1; SMN2
SCHEMBL29094065 0.70 CCR6 (0.51) ALDH1A1MEN1MAPTKMT2ATDP1
SCHEMBL7719640 0.69 S100A4 (0.50) S100A4ALDH1A1MEN1GUCY1B2MAPT
SCHEMBL7716516 0.69 PTPRC (0.64) S100A4ALDH1A1MEN1GUCY1B2MAPT
SCHEMBL7720681 0.69 PDE4A (0.49)
SCHEMBL31194263 0.68 PTPRC (0.43) ALDH1A1MEN1MAPTKMT2ASMN1; SMN2

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