SCHEMBL6739742

SCHEMBL6739742

Cc1c(N)cccc1NCc1cc(N)ccc1N

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.41
GAA P10253 3/20 0.41
MAPK1 P28482 2/20 0.41
TP53 P04637 2/20 0.41
HSD17B10 Q99714 2/20 0.41
TSHR P16473 2/20 0.39
CYP3A4 P08684 1/20 0.39
PIK3CA P42336 1/20 0.39
DHFR P00374 5/20 0.36
ALDH1A1 P00352 5/20 0.34
KMT2A Q03164 3/20 0.33
MEN1 O00255 2/20 0.33
HTT P42858 1/20 0.33
LMNA P02545 1/20 0.33
PAX8 Q06710 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
P2RY12 Q9H244 1/20 0.33
CASP1 P29466 1/20 0.32
KDM4E B2RXH2 2/20 0.32
POLB P06746 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) MAPTGAATP53HSD17B10ALDH1A1
SCHEMBL6742238 0.83 MAPT (0.40) MAPTGAAMAPK1TP53HSD17B10
SCHEMBL6272131 0.83 MAPT (0.51) MAPTGAAMAPK1TP53HSD17B10
SCHEMBL6735284 0.81 BPTF (0.35) MAPTGAAMAPK1TP53HSD17B10
SCHEMBL6735708 0.81 CA12 (0.39) MAPTGAAMAPK1TP53HSD17B10
SCHEMBL6740339 0.79 CA12 (0.40) MAPTGAAMAPK1TP53HSD17B10
SCHEMBL6744217 0.79 CASP1 (0.44) MAPTGAAMAPK1TSHRCYP3A4
SCHEMBL6266347 0.79 MAPT (0.43) MAPTMAPK1CYP3A4DHFRALDH1A1
SCHEMBL6740071 0.78 CASP1 (0.36) MAPTGAAMAPK1TP53HSD17B10
SCHEMBL6738673 0.78 GAA (0.42) MAPTGAAMAPK1TP53TSHR

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 2345/4885GAA 4499/4885MAPK1 287/4885

“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.