SCHEMBL2988151

SCHEMBL2988151

Nc1ccc(NCc2cccc(O)c2N)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.51
CA2 P00918 4/20 0.50
CA1 P00915 3/20 0.50
CA12 O43570 3/20 0.50
CA9 Q16790 3/20 0.50
HIF1A Q16665 1/20 0.46
ACHE P22303 2/20 0.46
APP P05067 2/20 0.44
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
RAB9A P51151 2/20 0.44
HTT P42858 1/20 0.44
HPGD P15428 1/20 0.44
MAOA P21397 1/20 0.42
MAOB P27338 1/20 0.42
EGFR P00533 1/20 0.42
NOX4 Q9NPH5 1/20 0.41
ALOX15 P16050 1/20 0.40
GAA P10253 2/20 0.40
MAPK1 P28482 1/20 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
SCHEMBL2987144 0.86 APP (0.58) MAPTCA2CA1CA12CA9
SCHEMBL2993419 0.82 MAOA (0.45) MAPTCA2CA1CA12CA9
SCHEMBL2993410 0.80 MAOA (0.46) MAPTCA2CA1CA12CA9
SCHEMBL2987096 0.79 CA2 (0.49) MAPTCA2CA1CA12CA9
SCHEMBL5272425 0.76 MAOA (0.42) MAPTCA2CA1CA12CA9
SCHEMBL11593766 0.75 MAPT (0.81) MAPTCA2CA1CA12CA9
SCHEMBL2991426 0.75 EGFR (0.62) MAPTCA2CA1CA12CA9
SCHEMBL2991048 0.75 ADRA2B (0.53) MAPTCA2CA1CA12CA9
SCHEMBL2983424 0.74 MAOA (0.51) MAPTCA2CA1CA12CA9
Hydrochloric Acid SCHEMBL2990403 0.74 EGFR (0.61) MAPTCA2CA1CA12CA9

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-RE41549-E1 Dyes for keratin fibers, the dyes containing n-benzyl-p-phenylenediamine derivatives and novel n-benzyl-p-phenylenediamine derivatives WELLA AG (DE) 2010-08-24 US disclosed
EP-1493731-A1 N-benzyl-p-phenylenediamine-derivatives containing colouring agents for keratin fibres and these derivatives Wella Aktiengesellschaft (DE) 2005-01-05 EP disclosed
US-6689174-B2 FOR OXIDATIVELY DYEING HUMAN HAIR WELLA AKTIENGESELLSCHAFT (DE) 2004-02-10 US disclosed
US-20020166181-A1 N-benzyl-p-phenylenediamine-derivatives containing colouring agents for keratin fibres and novel n-benzyl-p-phenylenediamine-derivatives CHASSOT LAURENT (CH) 2002-11-14 US disclosed
EP-1226107-A1 N-BENZYL-P-PHENYLENEDIAMINE-DERIVATIVES CONTAINING COLOURING AGENTS FOR KERATIN FIBRES AND NOVEL N-BENZYL-P-PHENYLENEDIAMINE-DERIVATIVES Wella Aktiengesellschaft (DE) 2002-07-31 EP disclosed
WO-2002018318-A1 N-BENZYL-P-PHENYLENEDIAMINE-DERIVATIVES CONTAINING COLOURING AGENTS FOR KERATIN FIBRES AND NOVEL N-BENZYL-P-PHENYLENEDIAMINE-DERIVATIVES WELLA AKTIENGESELLSCHAFT (DE) 2002-03-07 WO 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-20020166181-A1 N-benzyl-p-phenylenediamine-derivatives containing colouring agents for keratin fibres and novel n-benzyl-p-phenylenediamine-derivatives KRT18, KPNB1, VIM MAPT 725/4885CA2 2166/4885CA1 2791/4885

“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.