SCHEMBL4828253

SCHEMBL4828253

COC(=O)CCCNc1ccc(N)cc1

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.47
MAPT P10636 3/20 0.47
HSD17B10 Q99714 2/20 0.47
KDM4E B2RXH2 1/20 0.47
GAA P10253 1/20 0.47
TSHR P16473 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.44
POLB P06746 1/20 0.44
LMNA P02545 3/20 0.43
L3MBTL1 Q9Y468 1/20 0.42
CA1 P00915 2/20 0.41
CA2 P00918 2/20 0.41
CA12 O43570 1/20 0.41
CA9 Q16790 1/20 0.41
HTT P42858 2/20 0.41
KMT2A Q03164 1/20 0.41
HPGD P15428 1/20 0.41
RAB9A P51151 1/20 0.40

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
SCHEMBL4828263 0.94 KDM4E (0.54) ALDH1A1MAPTHSD17B10KDM4EGAA
SCHEMBL4824629 0.90 SMN1; SMN2 (0.54) ALDH1A1MAPTHSD17B10KDM4EGAA
SCHEMBL4823915 0.86 TOP2A (0.51) ALDH1A1MAPTKDM4EPOLBLMNA
SCHEMBL21186140 0.85 SMN1; SMN2 (0.50) ALDH1A1MAPTHSD17B10KDM4EGAA
SCHEMBL11136638 0.83 LTA4H (0.46) ALDH1A1MAPTHSD17B10KDM4EGAA
SCHEMBL11317810 0.83 MAPT (0.61) ALDH1A1MAPTHSD17B10GAASMN1; SMN2
SCHEMBL9756822 0.83 LMNA (0.60) ALDH1A1MAPTKDM4ETSHRSMN1; SMN2
SCHEMBL8739445 0.81 SMN1; SMN2 (0.47) ALDH1A1MAPTHSD17B10KDM4EGAA
SCHEMBL4828296 0.81 ALDH1A1 (0.51) ALDH1A1MAPTPOLBLMNACA1
SCHEMBL4826837 0.80 ALDH1A1 (0.48) ALDH1A1MAPTHSD17B10KDM4EGAA

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
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-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-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

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 1947/4885HSD17B10 1289/4885

“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.