SCHEMBL4829909

SCHEMBL4829909

Cc1cc(NCCC(=O)O)ccc1N

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.50
MAPT P10636 4/20 0.50
KMT2A Q03164 3/20 0.50
POLB P06746 2/20 0.50
HSD17B10 Q99714 2/20 0.50
MEN1 O00255 1/20 0.50
TSHR P16473 1/20 0.50
CASP1 P29466 1/20 0.50
HTT P42858 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
TDP1 Q9NUW8 3/20 0.46
CYP3A4 P08684 1/20 0.46
THRB P10828 1/20 0.46
ALOX15 P16050 1/20 0.46
RECQL P46063 1/20 0.46
HIF1A Q16665 1/20 0.46
KDM4E B2RXH2 2/20 0.45
PLA2G2A P14555 1/20 0.43
GAA P10253 1/20 0.42
APEX1 P27695 1/20 0.41

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
SCHEMBL6260953 0.91 ALDH1A1 (0.46) ALDH1A1MAPTKMT2APOLBHSD17B10
SCHEMBL4829880 0.88 ALDH1A1 (0.48) ALDH1A1MAPTKMT2AHSD17B10MEN1
SCHEMBL4820499 0.88 ALDH1A1 (0.48) ALDH1A1MAPTKMT2AHSD17B10MEN1
SCHEMBL4826980 0.84 SMN1; SMN2 (0.55) ALDH1A1MAPTPOLBHSD17B10HTT
SCHEMBL2126641 0.82 CYP3A4 (0.53) ALDH1A1MAPTTSHRHTTTDP1
SCHEMBL4826633 0.82 TOP2A (0.45) ALDH1A1MAPTKMT2APOLBSMN1; SMN2
SCHEMBL4880807 0.80 ALDH1A1 (0.49) ALDH1A1MAPTHSD17B10CASP1TDP1
SCHEMBL5930392 0.80 SMN1; SMN2 (0.41) ALDH1A1MAPTPOLBSMN1; SMN2TDP1
SCHEMBL6342530 0.80 ALDH1A1 (0.54) ALDH1A1MAPTKMT2APOLBHSD17B10
SCHEMBL6376391 0.79 ALDH1A1 (0.53) ALDH1A1MAPTTSHRHTTTDP1

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-7384432-B2 Secondary para-phenylenediamines having a carboxyl group, dye compositions comprising the same, and dyeing processes using the compositions L'OREAL S.A. (FR) 2008-06-10 US claimed
US-20060021159-A1 Secondary para-phenylenediamines having a carboxyl group, dye compositions comprising the same, and dyeing processes using the compositions L'OREAL S.A. (FR) 2006-02-02 US claimed
EP-1580186-A1 Secondary p-phenylendiamines containing a carboxylic acid group, dye composition containing them, processes and uses L'OREAL (FR) 2005-09-28 EP claimed
US-7384432-B2 Secondary para-phenylenediamines having a carboxyl group, dye compositions comprising the same, and dyeing processes using the compositions L'OREAL S.A. (FR) 2008-06-10 US disclosed
US-20060021159-A1 Secondary para-phenylenediamines having a carboxyl group, dye compositions comprising the same, and dyeing processes using the compositions L'OREAL S.A. (FR) 2006-02-02 US disclosed
EP-1580186-A1 Secondary p-phenylendiamines containing a carboxylic acid group, dye composition containing them, processes and uses L'OREAL (FR) 2005-09-28 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-20060021159-A1 Secondary para-phenylenediamines having a carboxyl group, dye compositions comprising the same, and dyeing processes using the compositions KRT18, CDC73, JUP ALDH1A1 509/4885MAPT 1947/4885KMT2A 1422/4885

“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.