SCHEMBL6737909

SCHEMBL6737909

CC(Nc1ccccc1N)c1cc(N)ccc1N

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.42
KDM4E B2RXH2 4/20 0.42
ALOX15 P16050 2/20 0.42
TP53 P04637 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
HSD17B10 Q99714 2/20 0.42
APP P05067 1/20 0.42
HPGD P15428 1/20 0.42
SNCA P37840 1/20 0.42
BLM P54132 1/20 0.42
HDAC3 O15379 4/20 0.37
HDAC1 Q13547 4/20 0.37
HDAC2 Q92769 4/20 0.37
NCOR2 Q9Y618 3/20 0.37
GAA P10253 5/20 0.36
ALDH1A1 P00352 5/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
LMNA P02545 1/20 0.36
CYP1A2 P05177 1/20 0.36

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
SCHEMBL6742154 0.87 CD44 (0.33) MAPTKDM4EALOX15TP53SMN1; SMN2
SCHEMBL6742125 0.86 CASP1 (0.38) MAPTALOX15GAAALDH1A1TDP1
SCHEMBL6735610 0.83 CHEK1 (0.40) MAPTKDM4EALOX15TP53SMN1; SMN2
SCHEMBL6483746 0.81 MEN1 (0.47) MAPTKDM4EALOX15HSD17B10HDAC3
SCHEMBL6740994 0.79
Hydrochloric Acid SCHEMBL6853519 0.78 CRHBP (0.49) MAPTALOX15SMN1; SMN2HPGDGAA
SCHEMBL28478972 0.78 MAPKAPK2 (0.46) MAPTKDM4EALOX15TP53SMN1; SMN2
SCHEMBL6739761 0.77 MEN1 (0.41) MAPTKDM4EALOX15TP53SMN1; SMN2
SCHEMBL6740985 0.76 MEN1 (0.35) MAPTGAAALDH1A1MEN1KMT2A
SCHEMBL6734145 0.76 MEN1 (0.43) MAPTKDM4ETP53SMN1; SMN2HDAC3

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 MAPT 2345/4885KDM4E 1123/4885ALOX15 1417/4885

“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.