SCHEMBL6573504

SCHEMBL6573504

NC(N)=NN=Cc1cc(O)ccc1N

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 2/20 0.55
TLR4 O00206 1/20 0.55
HTR2C P28335 1/20 0.54
GRIN2D O15399 12/20 0.49
GRIN3B O60391 12/20 0.49
GRIN1 Q05586 12/20 0.49
GRIN2A Q12879 12/20 0.49
GRIN2B Q13224 12/20 0.49
GRIN2C Q14957 12/20 0.49
GRIN3A Q8TCU5 12/20 0.49
MAPT P10636 2/20 0.48
ALDH1A1 P00352 1/20 0.48
GAA P10253 1/20 0.48
NPSR1 Q6W5P4 2/20 0.47
FURIN P09958 2/20 0.47
F2 P00734 1/20 0.47
PPP1R15A O75807 1/20 0.44
MELK Q14680 1/20 0.44
PPP1R15B Q5SWA1 1/20 0.44
L3MBTL1 Q9Y468 1/20 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
Hydrochloric Acid SCHEMBL7266211 0.98 TLR4 (0.58) HTR1ATLR4HTR2CGRIN2DGRIN3B
SCHEMBL6574017 0.84 TLR4 (0.52) TLR4GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL6572392 0.77 HTR1A (0.50) HTR1ATLR4HTR2CGRIN2DGRIN3B
SCHEMBL6574739 0.77 GRIN2D (0.59) TLR4GRIN2DGRIN3BGRIN1GRIN2A
Water SCHEMBL6574638 0.73 L3MBTL1 (0.60) HTR1ATLR4HTR2CGRIN2DGRIN3B
SCHEMBL3677559 0.72 CA14 (0.41) ALDH1A1GAAL3MBTL1
SCHEMBL6573966 0.71 TLR4 (0.40) TLR4GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL6572568 0.71 HTR1A (0.45) HTR1ATLR4HTR2CGRIN2DGRIN3B
SCHEMBL6573488 0.71 MAPT (0.59) TLR4GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL7341110 0.71 HTR1A (1.00) HTR1ATLR4HTR2CGRIN2DGRIN3B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1120405-B1 Oxidation bases with a guanidine chain, process for their preparation, their use for oxidation dyeing of keratinous fibers, dyeing compositions and dyeing processes OREAL (FR) 2004-10-27 EP claimed
US-20010034913-A1 Novel oxidation bases containing a guanidine chain, process for preparing them, their use for the oxidation dyeing of keratin fibers, dye compositions and dyeing processes L'OREAL S.A. (FR) 2001-11-01 US claimed
EP-1120405-A2 Oxidation bases with a guanidine chain, process for their preparation, their use for oxidation dyeing of keratinous fibers, dyeing compositions and dyeing processes L'OREAL (FR) 2001-08-01 EP claimed
EP-1120405-B1 Oxidation bases with a guanidine chain, process for their preparation, their use for oxidation dyeing of keratinous fibers, dyeing compositions and dyeing processes OREAL (FR) 2004-10-27 EP disclosed
US-6652600-B2 Oxidation color dye L'OREAL S.A. (FR) 2003-11-25 US disclosed
US-20010034913-A1 Novel oxidation bases containing a guanidine chain, process for preparing them, their use for the oxidation dyeing of keratin fibers, dye compositions and dyeing processes L'OREAL S.A. (FR) 2001-11-01 US disclosed
EP-1120405-A2 Oxidation bases with a guanidine chain, process for their preparation, their use for oxidation dyeing of keratinous fibers, dyeing compositions and dyeing processes L'OREAL (FR) 2001-08-01 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 (1 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-20010034913-A1 Novel oxidation bases containing a guanidine chain, process for preparing them, their use for the oxidation dyeing of keratin fibers, dye compositions and dyeing processes KRT18, OGG1, UNG HTR1A 4211/4885TLR4 3637/4885HTR2C 4267/4885

“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.