SCHEMBL5202190

SCHEMBL5202190

Nc1ccc(N2CCN(CCO)CC(CO)C2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.46
GFER P55789 4/20 0.46
KDM4E B2RXH2 4/20 0.46
SMN1; SMN2 Q16637 4/20 0.46
GAA P10253 3/20 0.46
RAD52 P43351 2/20 0.46
ALDH1A1 P00352 5/20 0.42
KMT2A Q03164 2/20 0.42
ADRA2C P18825 1/20 0.42
PTK2B Q14289 1/20 0.42
ESR2 Q92731 1/20 0.42
MAPK1 P28482 2/20 0.40
LMNA P02545 4/20 0.39
HTT P42858 2/20 0.39
TDP1 Q9NUW8 2/20 0.39
GBA1 P04062 1/20 0.39
HTR7 P34969 2/20 0.39
ESRRG P62508 2/20 0.39
CASP6 P55212 1/20 0.38
L3MBTL1 Q9Y468 2/20 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
SCHEMBL5202043 0.84 MAPT (0.47) MAPTGFERKDM4ESMN1; SMN2GAA
SCHEMBL5202350 0.84 MAPT (0.47) MAPTGFERKDM4ESMN1; SMN2GAA
SCHEMBL5203157 0.82 GAA (0.54) MAPTKDM4EGAARAD52ALDH1A1
SCHEMBL6151437 0.81 MAPT (0.62) MAPTGFERKDM4ESMN1; SMN2GAA
SCHEMBL188852 0.81 MAPT (0.62) MAPTGFERKDM4ESMN1; SMN2GAA
SCHEMBL6150880 0.81 MAPT (0.62) MAPTGFERKDM4ESMN1; SMN2GAA
SCHEMBL23983401 0.81 MAPT (0.44) MAPTGFERKDM4ESMN1; SMN2GAA
SCHEMBL13735219 0.79 MAPT (0.43) MAPTGFERKDM4ESMN1; SMN2GAA
SCHEMBL15652597 0.79 MAPT (0.43) MAPTGFERKDM4ESMN1; SMN2GAA
SCHEMBL15651591 0.79 MAPT (0.43) MAPTGFERKDM4ESMN1; SMN2GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1417184-B1 COMPOSITION FOR DYEING KERATINOUS FIBRES CONTAINING A PARAPHENYLENEDIAMINE SUBSTITUTED BY A DIAZACYCLOHEPTANE RADICAL OREAL (FR) 2007-08-29 EP claimed
US-7241317-B2 Composition for dyeing keratin fibers comprising at least one para-phenylenediamine substituted with a diazacycloheptane radical L'OREAL, S.A. (FR) 2007-07-10 US claimed
US-20050102769-A1 Composition for dyeing keratinous fibers containing a paraphenylenediamine substituted by a diazacycloheptane radical L'OREAL S.A. (FR) 2005-05-19 US claimed
EP-1417184-B1 COMPOSITION FOR DYEING KERATINOUS FIBRES CONTAINING A PARAPHENYLENEDIAMINE SUBSTITUTED BY A DIAZACYCLOHEPTANE RADICAL OREAL (FR) 2007-08-29 EP disclosed
US-7241317-B2 Composition for dyeing keratin fibers comprising at least one para-phenylenediamine substituted with a diazacycloheptane radical L'OREAL, S.A. (FR) 2007-07-10 US disclosed
US-7241317-B2 Composition for dyeing keratin fibers comprising at least one para-phenylenediamine substituted with a diazacycloheptane radical L'OREAL, S.A. (FR) 2007-07-10 US disclosed
US-7241317-B2 Composition for dyeing keratin fibers comprising at least one para-phenylenediamine substituted with a diazacycloheptane radical L'OREAL, S.A. (FR) 2007-07-10 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-20050102769-A1 Composition for dyeing keratinous fibers containing a paraphenylenediamine substituted by a diazacycloheptane radical KRT18, HPD, PPOX MAPT 2115/4885GFER 1097/4885KDM4E 1418/4885

“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.