SCHEMBL2921333

SCHEMBL2921333

CN(/N=C/c1ccnc2ccccc12)c1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.55
HPGD P15428 6/20 0.55
CYP1A2 P05177 3/20 0.55
HSD17B10 Q99714 2/20 0.55
NQO2 P16083 1/20 0.55
MEN1 O00255 11/20 0.47
KMT2A Q03164 11/20 0.47
MAPT P10636 10/20 0.47
TDP1 Q9NUW8 3/20 0.47
PIK3CA P42336 1/20 0.46
RAB9A P51151 6/20 0.45
NPC1 O15118 5/20 0.45
MAPK1 P28482 3/20 0.45
GAA P10253 2/20 0.45
HTT P42858 2/20 0.44
LMNA P02545 2/20 0.44
CASP3 P42574 1/20 0.44
SENP7 Q9BQF6 1/20 0.44
SMN1; SMN2 Q16637 5/20 0.44
CYP2C19 P33261 2/20 0.44

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
SCHEMBL2921336 1.00 ALDH1A1 (0.55) ALDH1A1HPGDCYP1A2HSD17B10NQO2
SCHEMBL1702914 0.77 MAPT (0.65) ALDH1A1HPGDMEN1KMT2AMAPT
SCHEMBL1702594 0.75 MEN1 (0.51) ALDH1A1HPGDCYP1A2HSD17B10MEN1
SCHEMBL28045461 0.75 MEN1 (0.51) ALDH1A1HPGDCYP1A2HSD17B10MEN1
SCHEMBL7384077 0.73 MAPT (0.57) ALDH1A1HPGDCYP1A2HSD17B10NQO2
SCHEMBL5289576 0.73 MAPT (0.51) ALDH1A1HPGDCYP1A2HSD17B10NQO2
SCHEMBL15841249 0.73 MAPT (0.53) ALDH1A1HPGDCYP1A2HSD17B10NQO2
SCHEMBL6096045 0.73 MAPT (0.51) ALDH1A1HPGDCYP1A2HSD17B10NQO2
SCHEMBL3652492 0.73 MAPT (0.53) ALDH1A1HPGDCYP1A2HSD17B10NQO2
SCHEMBL3652495 0.73 MAPT (0.53) ALDH1A1HPGDCYP1A2HSD17B10NQO2

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 21 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1647548-B1 Dictionic bishydrazones, dyeingcompositions containig at least one of these compounds, process of their preparation and uses thereoff OREAL (FR) 2010-08-25 EP disclosed
EP-1647548-B1 Dictionic bishydrazones, dyeingcompositions containig at least one of these compounds, process of their preparation and uses thereoff OREAL (FR) 2010-08-25 EP disclosed
US-7582122-B2 Mixed cationic dyes comprising at least one anthraquinone chromophore and their use in methods of hair dyeing L'OREAL S.A. (FR) 2009-09-01 US disclosed
US-7582122-B2 Mixed cationic dyes comprising at least one anthraquinone chromophore and their use in methods of hair dyeing L'OREAL S.A. (FR) 2009-09-01 US disclosed
US-7582122-B2 Mixed cationic dyes comprising at least one anthraquinone chromophore and their use in methods of hair dyeing L'OREAL S.A. (FR) 2009-09-01 US disclosed
US-7569079-B2 Polycationic monochromophoric hydrazone compounds, dye compositions comprising such polycationic compounds and dyeing process using them L'OREAL S.A. (FR) 2009-08-04 US disclosed
US-7569079-B2 Polycationic monochromophoric hydrazone compounds, dye compositions comprising such polycationic compounds and dyeing process using them L'OREAL S.A. (FR) 2009-08-04 US disclosed
US-20080263785-A1 Polycationic monochromophoric hydrazone compounds, dye compositions comprising such polycationic compounds and dyeing process using them L'OREAL S.A. (FR) 2008-10-30 US disclosed
US-20080263785-A1 Polycationic monochromophoric hydrazone compounds, dye compositions comprising such polycationic compounds and dyeing process using them L'OREAL S.A. (FR) 2008-10-30 US disclosed
EP-1980558-A1 Polycationic monochromophoric compounds of hydrazone type, dyeing compositions comprising same and dyeing method L'Oréal (FR) 2008-10-15 EP disclosed
US-7410506-B2 Dicationic bis-hydrazone compound, dye composition comprising at least one such compound, implementation process therefor and uses thereof L'OREAL S.A. (FR) 2008-08-12 US disclosed
US-7410506-B2 Dicationic bis-hydrazone compound, dye composition comprising at least one such compound, implementation process therefor and uses thereof L'OREAL S.A. (FR) 2008-08-12 US disclosed
WO-2007122340-A1 CATIONIC DICHROMOPHORIC COMPOUND CONTAINING TWO UNITS OF HYDRAZONE TYPE AND COMPRISING A CATIONIC LINKER ARM, DYE COMPOSITION COMPRISING AT LEAST ONE SUCH COMPOUND, METHOD FOR THE USE THEREOF AND USES L'ORÉAL (FR) 2007-11-01 WO disclosed
US-20070125261-A1 Mixed cationic dyes comprising at least one anthraquinone chromophore and their use in methods of hair dyeing L'OREAL S.A. (FR) 2007-06-07 US disclosed
US-20070125261-A1 Mixed cationic dyes comprising at least one anthraquinone chromophore and their use in methods of hair dyeing L'OREAL S.A. (FR) 2007-06-07 US disclosed
US-20070125261-A1 Mixed cationic dyes comprising at least one anthraquinone chromophore and their use in methods of hair dyeing L'OREAL S.A. (FR) 2007-06-07 US disclosed
EP-1757660-A1 Cationic mixed dyestuffs comprising an anthraquinone chromophore and their use for hair colouring L'Oréal (FR) 2007-02-28 EP disclosed
EP-1757660-A1 Cationic mixed dyestuffs comprising an anthraquinone chromophore and their use for hair colouring L'Oréal (FR) 2007-02-28 EP disclosed
US-20060096043-A1 Dicationic bis-hydrazone compound, dye composition comprising at least one such compound, implementation process therefor and uses thereof L'OREAL S.A. (FR) 2006-05-11 US disclosed
EP-1647548-A1 Dictionic bishydrazones, dyeingcompositions containig at least one of these compounds, process of their preparation and uses thereoff L'OREAL S.A. (FR) 2006-04-19 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20060096043-A1 Dicationic bis-hydrazone compound, dye composition comprising at least one such compound, implementation process therefor and uses thereof KRT18, DSC1, DSG1 ALDH1A1 1178/4885HPGD 760/4885CYP1A2 2641/4885
US-20080263785-A1 Polycationic monochromophoric hydrazone compounds, dye compositions comprising such polycationic compounds and dyeing process using them KRT18, CKMT1A; CKMT1B, XRCC5 ALDH1A1 2546/4885HPGD 703/4885CYP1A2 1430/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.