SCHEMBL4824629

SCHEMBL4824629

COC(=O)CCNc1ccc(N)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.54
POLB P06746 1/20 0.50
MAPT P10636 4/20 0.43
ALDH1A1 P00352 3/20 0.43
HTT P42858 3/20 0.43
HSD17B10 Q99714 2/20 0.43
LMNA P02545 1/20 0.43
KMT2A Q03164 1/20 0.43
HPGD P15428 1/20 0.42
RAB9A P51151 1/20 0.42
TSHR P16473 1/20 0.41
GAA P10253 2/20 0.41
CA12 O43570 3/20 0.40
CA14 Q9ULX7 3/20 0.40
CA7 P43166 2/20 0.40
CA2 P00918 1/20 0.40
CA9 Q16790 1/20 0.40
CA1 P00915 1/20 0.40
APP P05067 1/20 0.40
KDM4E B2RXH2 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
SCHEMBL21186140 0.95 SMN1; SMN2 (0.50) SMN1; SMN2POLBMAPTALDH1A1HTT
SCHEMBL8739445 0.91 SMN1; SMN2 (0.47) SMN1; SMN2POLBMAPTALDH1A1HTT
SCHEMBL4828253 0.90 ALDH1A1 (0.47) SMN1; SMN2POLBMAPTALDH1A1HTT
SCHEMBL4828263 0.87 KDM4E (0.54) SMN1; SMN2POLBMAPTALDH1A1HSD17B10
SCHEMBL4824465 0.85 TOP2A (0.49) SMN1; SMN2POLBMAPTALDH1A1HTT
SCHEMBL31601639 0.84 SMN1; SMN2 (0.55) SMN1; SMN2POLBMAPTALDH1A1HTT
SCHEMBL5184390 0.84 SMN1; SMN2 (0.55) SMN1; SMN2POLBMAPTALDH1A1HTT
SCHEMBL13948407 0.84 MAPT (0.57) SMN1; SMN2POLBMAPTALDH1A1HTT
SCHEMBL5930648 0.83 POLB (0.42) SMN1; SMN2POLBMAPTLMNAKMT2A
Hydrochloric Acid SCHEMBL4829831 0.83 TOP2A (0.48) SMN1; SMN2POLBMAPTALDH1A1HTT

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 SMN1; SMN2 4864/4885POLB 1504/4885MAPT 1947/4885

“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.