SCHEMBL6740071

SCHEMBL6740071

Cc1cccc(N)c1NCc1cc(N)ccc1N

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CASP1 P29466 2/20 0.36
CD44 P16070 1/20 0.36
GAA P10253 2/20 0.36
RAPGEF4 Q8WZA2 1/20 0.34
ALDH1A1 P00352 4/20 0.33
CYP3A4 P08684 3/20 0.33
KDM4E B2RXH2 2/20 0.33
HPGD P15428 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
MAPT P10636 3/20 0.32
ANPEP P15144 1/20 0.32
DPP4 P27487 1/20 0.32
TP53 P04637 1/20 0.32
MAPK1 P28482 1/20 0.32
HSD17B10 Q99714 1/20 0.32
LCK P06239 2/20 0.32
TSHR P16473 1/20 0.31
PIK3CA P42336 1/20 0.31
NPSR1 Q6W5P4 2/20 0.31
ADRA2B P18089 1/20 0.31

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
SCHEMBL7203333 0.89 ALDH1A1 (0.38) GAAALDH1A1CYP3A4KDM4EHPGD
SCHEMBL6741742 0.81 PLAU (0.38) GAAALDH1A1HPGDTDP1MAPT
SCHEMBL6734255 0.81 BCHE (0.34) CASP1GAAALDH1A1CYP3A4HPGD
SCHEMBL6742538 0.81 GAA (0.41) GAAALDH1A1KDM4EHPGDTDP1
SCHEMBL6742238 0.80 MAPT (0.40) CASP1CD44GAAALDH1A1CYP3A4
SCHEMBL6272131 0.79 MAPT (0.51) CASP1GAAALDH1A1CYP3A4KDM4E
SCHEMBL6739742 0.78 MAPT (0.41) CASP1GAAALDH1A1CYP3A4KDM4E
SCHEMBL6734298 0.78 GAA (0.32) GAAALDH1A1KDM4ETDP1
SCHEMBL6266347 0.76 MAPT (0.43) CASP1ALDH1A1CYP3A4TDP1MAPT
SCHEMBL6744217 0.76 CASP1 (0.44) CASP1GAAALDH1A1CYP3A4MAPT

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 4 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-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 CASP1 904/4885CD44 649/4885GAA 4499/4885

“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.