SCHEMBL6220147

SCHEMBL6220147

Cc1cc(N2CC(O)CCC(O)C2)ccc1N

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAD52 P43351 3/20 0.50
GAA P10253 3/20 0.50
THRB P10828 1/20 0.43
MAPT P10636 3/20 0.41
KDM4E B2RXH2 2/20 0.41
AR P10275 2/20 0.38
ALDH1A1 P00352 2/20 0.38
TDP1 Q9NUW8 2/20 0.38
CYP3A4 P08684 1/20 0.38
TSHR P16473 1/20 0.38
CDK1 P06493 2/20 0.38
CDK2 P24941 2/20 0.38
LGMN Q99538 1/20 0.37
MAPK1 P28482 2/20 0.36
HTT P42858 2/20 0.36
RECQL P46063 1/20 0.36
PTK2B Q14289 1/20 0.36
ESR1 P03372 1/20 0.35
ESR2 Q92731 1/20 0.35
LOXL2 Q9Y4K0 1/20 0.34

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
SCHEMBL1537907 0.90 RAD52 (0.51) RAD52GAATHRBMAPTKDM4E
Hydrochloric Acid SCHEMBL5383213 0.89 RAD52 (0.50) RAD52GAATHRBMAPTKDM4E
SCHEMBL6706979 0.86 RAD52 (0.53) RAD52GAATHRBMAPTKDM4E
SCHEMBL6221179 0.83 GAA (0.50) RAD52GAATHRBMAPTKDM4E
SCHEMBL6709032 0.81 GAA (0.54) RAD52GAATHRBMAPTKDM4E
SCHEMBL6710488 0.81 GAA (0.48) RAD52GAATHRBMAPTKDM4E
SCHEMBL6254071 0.81 GAA (0.55) RAD52GAATHRBMAPTKDM4E
SCHEMBL5202869 0.80 GAA (0.51) RAD52GAATHRBMAPTKDM4E
SCHEMBL6220205 0.80 GAA (0.58) RAD52GAATHRBMAPTKDM4E
SCHEMBL6746065 0.80 RAD52 (0.45) RAD52GAATHRBMAPTKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1512684-A1 use of derivative of para-phenylenediamine substituted by a homopiperidine ring, for the dyeing of keratinous fibres L'OREAL (FR) 2005-03-09 EP claimed
EP-1512684-A1 use of derivative of para-phenylenediamine substituted by a homopiperidine ring, for the dyeing of keratinous fibres L'OREAL (FR) 2005-03-09 EP disclosed
EP-1512684-A1 use of derivative of para-phenylenediamine substituted by a homopiperidine ring, for the dyeing of keratinous fibres L'OREAL (FR) 2005-03-09 EP disclosed