SCHEMBL4852978

SCHEMBL4852978

CCN(CC)CC(O)COCCCNc1ccc(N)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.38
ACHE P22303 4/20 0.38
CASR P41180 2/20 0.37
HTT P42858 1/20 0.35
SCN5A Q14524 2/20 0.35
MAOA P21397 2/20 0.35
MAPK1 P28482 2/20 0.35
HRH3 Q9Y5N1 2/20 0.35
CYP1A2 P05177 1/20 0.35
CNR1 P21554 1/20 0.35
DRD4 P21917 1/20 0.35
HRH2 P25021 1/20 0.35
HTR2A P28223 1/20 0.35
HTR2C P28335 1/20 0.35
NTSR1 P30989 1/20 0.35
HRH1 P35367 1/20 0.35
DRD3 P35462 1/20 0.35
SCN1A P35498 1/20 0.35
HTR2B P41595 1/20 0.35
SCN7A Q01118 1/20 0.35

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
SCHEMBL5904812 0.81 USP2 (0.41) CASRALDH1A1USP2
SCHEMBL11789982 0.79 SCN5A (0.43) LMNAACHESCN5AMAOAMAPK1
SCHEMBL4850035 0.77 BCL2 (0.39) LMNAACHEHTTMAOAMAPK1
SCHEMBL11494231 0.75 SCN5A (0.42) LMNAACHESCN5AMAOAMAPK1
SCHEMBL11793095 0.75 KDM4E (0.42) LMNAMAPK1KDM4ERAB9ATSHR
SCHEMBL4949096 0.74 CYP3A4 (0.52) LMNAACHESCN5AMAOAMAPK1
SCHEMBL13713957 0.74 USP2 (0.55) LMNAACHEHTTCYP1A2CYP3A4
SCHEMBL4845349 0.74 KMT2A (0.46) KDM4ETSHRALDH1A1CYP2C19CYP2D6
SCHEMBL6677560 0.73 APP (0.43) SCN5AMAOAABCB11CYP3A4ADRA2B
SCHEMBL20228146 0.73 USP2 (0.53) LMNAACHECASRHTTMAPK1

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-7435268-B2 N-alkylhydroxylated secondary para-phenylenediamine compounds, composition for dyeing keratin fibers comprising the same, and dyeing processes using the composition L'OREAL S.A. (FR) 2008-10-14 US claimed
US-20060005322-A1 N-alkylhydroxylated secondary para-phenylenediamine compounds, composition for dyeing keratin fibers comprising the same, and dyeing processes using the composition L'OREAL S.A. (FR) 2006-01-12 US claimed
EP-1580185-A1 Secondary n-Alkylhydroxylated p-Phenylendiamins, dye composition for keratin fibers containing them, processes and uses. L'OREAL (FR) 2005-09-28 EP claimed
US-7435268-B2 N-alkylhydroxylated secondary para-phenylenediamine compounds, composition for dyeing keratin fibers comprising the same, and dyeing processes using the composition L'OREAL S.A. (FR) 2008-10-14 US disclosed
US-7435268-B2 N-alkylhydroxylated secondary para-phenylenediamine compounds, composition for dyeing keratin fibers comprising the same, and dyeing processes using the composition L'OREAL S.A. (FR) 2008-10-14 US 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-20060005322-A1 N-alkylhydroxylated secondary para-phenylenediamine compounds, composition for dyeing keratin fibers comprising the same, and dyeing processes using the composition KRT18, CDC73, PRKDC LMNA 285/4885ACHE 1363/4885CASR 4758/4885

“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.