SCHEMBL6234580

SCHEMBL6234580

CNCCCCCCN(C)c1ccc(N)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.41
CYP3A4 P08684 3/20 0.41
TDP1 Q9NUW8 3/20 0.41
MAPK1 P28482 2/20 0.41
TP53 P04637 1/20 0.41
ALOX15 P16050 1/20 0.41
L3MBTL1 Q9Y468 3/20 0.37
PSMD14 O00487 1/20 0.37
TSHR P16473 1/20 0.37
RECQL P46063 1/20 0.37
GFER P55789 1/20 0.37
SIGMAR1 Q99720 1/20 0.37
MAPT P10636 3/20 0.35
EPHX1 P07099 1/20 0.33
SYK P43405 1/20 0.33
NOS1 P29475 1/20 0.33
NOS2 P35228 1/20 0.33
HRH3 Q9Y5N1 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 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
SCHEMBL6390732 0.98 ALDH1A1 (0.42) ALDH1A1CYP3A4TDP1MAPK1TP53
SCHEMBL6387441 0.93 ALDH1A1 (0.43) ALDH1A1CYP3A4TDP1MAPK1TP53
SCHEMBL6241015 0.85 ALDH1A1 (0.46) ALDH1A1CYP3A4TDP1MAPK1TP53
Hydrochloric Acid SCHEMBL6387557 0.84 ALDH1A1 (0.45) ALDH1A1CYP3A4TDP1MAPK1TP53
SCHEMBL26515833 0.82 RAB9A (0.45) ALDH1A1ALOX15L3MBTL1TSHRSIGMAR1
SCHEMBL10955815 0.81 ALDH1A1 (0.54) ALDH1A1CYP3A4TDP1MAPK1TP53
SCHEMBL11787777 0.80 MAPT (0.49) ALDH1A1CYP3A4TDP1MAPK1TP53
SCHEMBL6239446 0.80 S100B (0.45) ALDH1A1CYP3A4TDP1TSHRSIGMAR1
SCHEMBL20764387 0.79 ALDH1A1 (0.43) ALDH1A1CYP3A4TDP1MAPK1TP53
SCHEMBL27504680 0.79 EPHX1 (0.43) SIGMAR1MAPTEPHX1HRH3

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-20050132507-A1 Tertiary p-phenylenediamines, dyes compositions, and dyeing processes L'OREAL S.A. (FR) 2005-06-23 US claimed
CN-1660773-A Tertiary p-phenylenediamines, dyes compositions comprising thereof, and dyeing processes using the same OREAL (FR) 2005-08-31 CN disclosed
US-20050132507-A1 Tertiary p-phenylenediamines, dyes compositions, and dyeing processes L'OREAL S.A. (FR) 2005-06-23 US disclosed
EP-1535899-A1 Dyeing composition comprising at least one tertiary particular p-phenylenediamine, colouring method using same L'OREAL (FR) 2005-06-01 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-20050132507-A1 Tertiary p-phenylenediamines, dyes compositions, and dyeing processes KRT18, CDC73, DSP ALDH1A1 1367/4885CYP3A4 1356/4885TDP1 820/4885

“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.