SCHEMBL4816515

SCHEMBL4816515

Cc1cc(N)ccc1NCCOS(=O)(=O)O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.40
CYP1A2 P05177 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
RAD52 P43351 1/20 0.39
HSD17B10 Q99714 1/20 0.39
L3MBTL1 Q9Y468 3/20 0.39
ALDH1A1 P00352 3/20 0.39
KDM4E B2RXH2 2/20 0.39
POLB P06746 2/20 0.39
GAA P10253 2/20 0.39
RECQL P46063 2/20 0.39
CASP6 P55212 2/20 0.39
TDP1 Q9NUW8 2/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
ELAVL1 Q15717 1/20 0.39
PTGER4 P35408 3/20 0.38
SIGMAR1 Q99720 1/20 0.38
NQO2 P16083 4/20 0.37

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
SCHEMBL7809571 0.85 PTGER4 (0.46) MAPTHSD17B10L3MBTL1ALDH1A1KDM4E
Sulfuric Acid SCHEMBL4626210 0.81 MAPT (0.43) MAPTCYP1A2CYP2C9CYP2C19RAD52
SCHEMBL4824279 0.81 CYP2D6 (0.46) MAPTCYP1A2CYP2C9CYP2C19RAD52
SCHEMBL9728996 0.81 RAPGEF4 (0.40) MAPTHSD17B10L3MBTL1ALDH1A1KDM4E
Sulfuric Acid SCHEMBL11060632 0.79 MAPT (0.42) MAPTCYP1A2CYP2C9CYP2C19RAD52
SCHEMBL9639606 0.79 MAPT (0.56) MAPTALDH1A1KDM4EGAATDP1
SCHEMBL11311817 0.79 PTGER4 (0.50) MAPTCYP1A2CYP2C9CYP2C19RAD52
SCHEMBL14028546 0.78 NQO2 (0.38) MAPTCYP1A2CYP2C9CYP2C19RAD52
SCHEMBL14253796 0.77 L3MBTL1 (0.47) MAPTCYP1A2CYP2C9CYP2C19RAD52
SCHEMBL14253828 0.77 MAPT (0.40) MAPTCYP1A2CYP2C9CYP2C19RAD52

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 claimed
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
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
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-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 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 MAPT 2238/4885CYP1A2 3896/4885CYP2C9 2214/4885

“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.