SCHEMBL5836183

SCHEMBL5836183

CN1CCN(C2CCN(c3ccc(N)cc3)C2)CC1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.59
ALDH1A1 P00352 4/20 0.59
KDM4E B2RXH2 3/20 0.59
GAA P10253 3/20 0.59
KMT2A Q03164 3/20 0.59
GFER P55789 3/20 0.59
ADRA2C P18825 2/20 0.59
PTK2B Q14289 1/20 0.59
ESR2 Q92731 1/20 0.59
L3MBTL1 Q9Y468 4/20 0.46
L3MBTL3 Q96JM7 3/20 0.46
HRH3 Q9Y5N1 2/20 0.41
HTT P42858 2/20 0.40
MEN1 O00255 1/20 0.40
NPC1 O15118 1/20 0.40
USP2 O75604 1/20 0.40
TP53 P04637 1/20 0.40
POLB P06746 1/20 0.40
THRB P10828 1/20 0.40
ALOX15 P16050 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
SCHEMBL5836939 0.94 KDM4E (0.53) MAPTALDH1A1KDM4EGAAKMT2A
SCHEMBL521150 0.91 KDM4E (0.56) MAPTALDH1A1KDM4EGAAKMT2A
SCHEMBL156422 0.90 ALDH1A1 (0.68) MAPTALDH1A1KDM4EGAAKMT2A
SCHEMBL5202381 0.85 L3MBTL3 (0.65) MAPTALDH1A1KDM4EGAAKMT2A
SCHEMBL156523 0.84 MAPT (0.68) MAPTALDH1A1KDM4EGAAKMT2A
SCHEMBL5836445 0.84 L3MBTL3 (0.62) MAPTALDH1A1KDM4EGAAKMT2A
SCHEMBL5836988 0.81 GAA (0.46) MAPTALDH1A1KDM4EGAAKMT2A
SCHEMBL5832389 0.81 MAPT (0.49) MAPTALDH1A1KDM4EGAAKMT2A
SCHEMBL12005958 0.81 HRH3 (0.52) MAPTALDH1A1KDM4EGAAKMT2A
SCHEMBL12005460 0.81 HRH3 (0.52) MAPTALDH1A1KDM4EGAAKMT2A

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-7132534-B2 Para-phenylenediamine derivatives containing a pyrrolidyl group, and use of these derivatives for coloring keratin fibers L'OREAL (FR) 2006-11-07 US claimed
US-20040077852-A1 Para-phenylenediamine derivatives containing a pyrrolidyl group, and use of these derivatives for coloring keratin fibers L'OREAL S.A. (FR) 2004-04-22 US claimed
EP-1378230-A1 Para-phenylenediamine derivatives comprising a pyrrolidinyl group substituted by a cyclic radical and their use in colouring keratinic fibres L'OREAL (FR) 2004-01-07 EP claimed
US-7132534-B2 Para-phenylenediamine derivatives containing a pyrrolidyl group, and use of these derivatives for coloring keratin fibers L'OREAL (FR) 2006-11-07 US disclosed
US-20040077852-A1 Para-phenylenediamine derivatives containing a pyrrolidyl group, and use of these derivatives for coloring keratin fibers L'OREAL S.A. (FR) 2004-04-22 US disclosed
EP-1378230-A1 Para-phenylenediamine derivatives comprising a pyrrolidinyl group substituted by a cyclic radical and their use in colouring keratinic fibres L'OREAL (FR) 2004-01-07 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-20040077852-A1 Para-phenylenediamine derivatives containing a pyrrolidyl group, and use of these derivatives for coloring keratin fibers KRT18, CDC73, VIM MAPT 1211/4885ALDH1A1 1327/4885KDM4E 590/4885

“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.