SCHEMBL6735284

SCHEMBL6735284

Nc1ccc(N)c(CNc2cccc(N)c2Cl)c1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BPTF Q12830 1/20 0.35
EGFR P00533 2/20 0.33
IGF1R P08069 2/20 0.33
ALDH1A1 P00352 3/20 0.33
ALOX15 P16050 3/20 0.33
GAA P10253 1/20 0.33
HTT P42858 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
MAPT P10636 3/20 0.32
MEN1 O00255 3/20 0.32
KMT2A Q03164 3/20 0.32
HSD17B10 Q99714 3/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
HPGD P15428 2/20 0.32
CA12 O43570 1/20 0.32
CA2 P00918 1/20 0.32
CA9 Q16790 1/20 0.32
KDM4E B2RXH2 1/20 0.32
TP53 P04637 1/20 0.32
APP P05067 1/20 0.32

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
SCHEMBL6269483 0.83 MAPT (0.43) EGFRALDH1A1ALOX15GAAHTT
SCHEMBL6740781 0.83 MAPT (0.35) BPTFEGFRIGF1RALDH1A1ALOX15
SCHEMBL6271939 0.83 KMT2A (0.47) ALDH1A1ALOX15GAAHTTTDP1
SCHEMBL6735708 0.81 CA12 (0.39) ALDH1A1ALOX15GAAHTTTDP1
SCHEMBL6739742 0.81 MAPT (0.41) ALDH1A1ALOX15GAAHTTMAPT
SCHEMBL6269473 0.80 ALDH1A1 (0.43) ALDH1A1ALOX15GAAHTTTDP1
SCHEMBL6266814 0.79 CA12 (0.51) ALDH1A1ALOX15GAAHTTTDP1
SCHEMBL6270642 0.79 HPGD (0.43) ALDH1A1ALOX15GAAHTTMAPT
SCHEMBL6734215 0.79 CYP3A4 (0.41) ALDH1A1ALOX15GAAHTTTDP1
SCHEMBL6738506 0.79 PRKCI (0.42) EGFRALDH1A1ALOX15GAAHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6685751-B2 SUCH AS 2-((2-AMINO-PHENYLAMINO)-METHYL)-1,4-DIAMINOBENZENE; HAIR DYES WELLA AKTIENGESELLSCHAFT (DE) 2004-02-03 US disclosed
US-6602302-B1 Mixtures of carbocyclic amines such as 2-((2-aminophenylamino) -methyl)-1,4-diaminobenzene, couplers and developers, having photostability, wash and colorfastness, used for dyeing human hair WELLA AG (DE) 2003-08-05 US disclosed
US-20030110578-A1 Substituted 1,4-diaminobenzene compounds and oxidation dye precursor compositions containing same WELLA INTERNATIONAL OPERATIONS SWITZERLAND SARL (CH) 2003-06-19 US disclosed
EP-1108708-B1 1,4-Diaminobenzene derivatives and colouring agents containing these compounds WELLA AG (DE) 2003-01-08 EP disclosed
EP-1108708-A1 1,4-Diaminobenzene derivatives and colouring agents containing these compounds Wella Aktiengesellschaft (DE) 2001-06-20 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-20030110578-A1 Substituted 1,4-diaminobenzene compounds and oxidation dye precursor compositions containing same KRT18, AOC1, DAO BPTF 3454/4885EGFR 1114/4885IGF1R 4597/4885

“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.