SCHEMBL6574652

SCHEMBL6574652

N=C(N)N(N=Cc1cccc(N)c1)N1CCCC1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 3/20 0.34
MAOA P21397 1/20 0.34
MAOB P27338 1/20 0.34
NPSR1 Q6W5P4 1/20 0.33
F2 P00734 1/20 0.33
PLG P00747 1/20 0.33
PRSS1 P07477 1/20 0.33
PRSS2 P07478 1/20 0.33
PRSS3 P35030 1/20 0.33
FURIN P09958 1/20 0.33
ACHE P22303 2/20 0.32
MAPT P10636 2/20 0.31
GFER P55789 2/20 0.31
KDM4E B2RXH2 2/20 0.31
MEN1 O00255 1/20 0.31
THRB P10828 1/20 0.31
ALOX15 P16050 1/20 0.31
YWHAG P61981 1/20 0.31
KMT2A Q03164 1/20 0.31
HSD17B10 Q99714 1/20 0.31

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
SCHEMBL6574655 0.66 POLB (0.46) MAOBGFERMEN1KMT2APOLB
SCHEMBL13269424 0.64 CYP19A1 (0.52) CYP19A1MAOAMAOBNPSR1FURIN
SCHEMBL11883864 0.64 CYP19A1 (0.52) CYP19A1MAOAMAOBNPSR1FURIN
SCHEMBL11883859 0.64 CYP19A1 (0.52) CYP19A1MAOAMAOBNPSR1FURIN
Hydrochloric Acid SCHEMBL9324263 0.64 POLB (0.54) CYP19A1MAOAMAOBF2PLG
SCHEMBL11957621 0.62 CYP19A1 (0.54) CYP19A1MAOAMAOBNPSR1FURIN
Hydrochloric Acid SCHEMBL9324272 0.61 FURIN (0.76) F2FURIN
SCHEMBL17285059 0.60 G6PC1 (0.70) CYP19A1MAOAMAOBMAPTMEN1
Hydrochloric Acid SCHEMBL2947932 0.60 FURIN (0.41) FURINPOLB
SCHEMBL7594901 0.58 GRIN1 (0.47) F2MAPTKDM4EMEN1KMT2A

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 CYP19A1 4380/4885MAOA 649/4885MAOB 325/4885

“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.