SCHEMBL6740930

SCHEMBL6740930

CN(Cc1cc(N)ccc1N)c1ccc(N(CCO)CCO)cc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKCI P41743 1/20 0.37
ACHE P22303 1/20 0.36
MAPK1 P28482 3/20 0.36
TDP1 Q9NUW8 3/20 0.36
L3MBTL1 Q9Y468 3/20 0.36
ALDH1A1 P00352 2/20 0.36
CYP3A4 P08684 2/20 0.36
PSMD14 O00487 1/20 0.36
TSHR P16473 1/20 0.36
RECQL P46063 1/20 0.36
GFER P55789 1/20 0.36
S100B P04271 1/20 0.32
TP53 P04637 2/20 0.32
ALOX15 P16050 1/20 0.32
MAPT P10636 3/20 0.32
KMT2A Q03164 3/20 0.32
MEN1 O00255 2/20 0.32
LMNA P02545 2/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
GAA P10253 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
SCHEMBL6738059 0.87 PRKCI (0.35) PRKCIACHEALDH1A1CYP3A4MAPT
SCHEMBL6741221 0.84 ALDH1A1 (0.45) PRKCIACHEMAPK1TDP1L3MBTL1
SCHEMBL6429126 0.83 TDP1 (0.39) PRKCIACHEMAPK1TDP1L3MBTL1
SCHEMBL7494519 0.82 TDP1 (0.38) PRKCIACHEMAPK1TDP1L3MBTL1
SCHEMBL6743260 0.80 PRKCI (0.36) PRKCIACHEALDH1A1KMT2AMEN1
SCHEMBL6739797 0.78 PRKCI (0.40) PRKCIACHEMAPK1TDP1L3MBTL1
SCHEMBL6269217 0.78 PRKCI (0.43) PRKCIACHEMAPK1TDP1L3MBTL1
SCHEMBL6268444 0.77 ADRA2B (0.37) MAPK1TDP1L3MBTL1ALDH1A1CYP3A4
SCHEMBL6740926 0.77 PRKCI (0.37) PRKCIACHEMAPK1TDP1ALDH1A1
Hydrochloric Acid SCHEMBL6848904 0.76 ACHE (0.45) PRKCIACHETDP1L3MBTL1ALDH1A1

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 PRKCI 2922/4885ACHE 2422/4885MAPK1 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.