SCHEMBL6101586

SCHEMBL6101586

CCN(CCNc1ccc(N)cc1C)S(C)(=O)=O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.40
ALDH1A1 P00352 4/20 0.37
MAPT P10636 3/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
RAD52 P43351 1/20 0.35
SIGMAR1 Q99720 1/20 0.33
MEN1 O00255 3/20 0.33
KMT2A Q03164 3/20 0.33
MPO P05164 2/20 0.33
SLC6A4 P31645 2/20 0.33
LMNA P02545 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
AR P10275 1/20 0.33
VDR P11473 1/20 0.33
KDM4E B2RXH2 1/20 0.32
POLB P06746 1/20 0.32
GAA P10253 1/20 0.32
RECQL P46063 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
SCHEMBL4823208 0.83 L3MBTL1 (0.41) L3MBTL1ALDH1A1MAPTCYP1A2CYP2C9
SCHEMBL4816532 0.83 L3MBTL1 (0.38) L3MBTL1ALDH1A1MAPTCYP1A2CYP2C9
SCHEMBL8360612 0.80 MAPT (0.53) ALDH1A1MAPTCYP2C9MEN1KMT2A
SCHEMBL10895266 0.79 CA1 (0.38) L3MBTL1ALDH1A1CYP2C19MPOSLC6A4
SCHEMBL14253796 0.78 L3MBTL1 (0.47) L3MBTL1ALDH1A1MAPTCYP1A2CYP2C9
Sulfuric Acid SCHEMBL8019180 0.77 MAPT (0.49) ALDH1A1MAPTCYP2C9MEN1KMT2A
SCHEMBL5157623 0.76 ALDH1A1 (0.41) L3MBTL1ALDH1A1MAPTCYP1A2CYP2C9
SCHEMBL10903222 0.76 MPO (0.45) L3MBTL1ALDH1A1MAPTCYP1A2MEN1
SCHEMBL9178888 0.76 S100B (0.42) ALDH1A1MAPTCYP1A2CYP2C9CYP2C19
SCHEMBL4824434 0.76 MAPT (0.47) L3MBTL1ALDH1A1MAPTCYP1A2CYP2C9

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-20060005321-A1 Sulfur-containing secondary para-phenylenediamines dye compositions comprising such para-phenylenediamines, processes, and uses thereof L'OREAL S.A. (FR) 2006-01-12 US claimed
EP-1568687-A1 Sulphur-containing secondary para-Phenylenediamines, dying composition containing such para-phenylenediamines and methods using this composition and use L'OREAL (FR) 2005-08-31 EP claimed
US-7347879-B2 Sulfur-containing secondary para-phenylenediamines dye compositions comprising such para-phenylenediamines, processes, and uses thereof L'Oreál, S.A. (FR) 2008-03-25 US disclosed
US-7347879-B2 Sulfur-containing secondary para-phenylenediamines dye compositions comprising such para-phenylenediamines, processes, and uses thereof L'Oreál, S.A. (FR) 2008-03-25 US disclosed
EP-1568687-A1 Sulphur-containing secondary para-Phenylenediamines, dying composition containing such para-phenylenediamines and methods using this composition and use L'OREAL (FR) 2005-08-31 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-20060005321-A1 Sulfur-containing secondary para-phenylenediamines dye compositions comprising such para-phenylenediamines, processes, and uses thereof KRT18, CDC73, DSG1 L3MBTL1 4183/4885ALDH1A1 1148/4885MAPT 2238/4885

“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.