SCHEMBL6258199

SCHEMBL6258199

Nc1ccc(N2CCCCC(O)CC2)cc1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.61
ALDH1A1 P00352 6/20 0.61
L3MBTL1 Q9Y468 5/20 0.61
GAA P10253 4/20 0.61
KDM4E B2RXH2 3/20 0.61
HTT P42858 3/20 0.61
KMT2A Q03164 3/20 0.61
ALOX15 P16050 3/20 0.61
MEN1 O00255 2/20 0.61
NPC1 O15118 1/20 0.61
USP2 O75604 1/20 0.61
TP53 P04637 1/20 0.61
POLB P06746 1/20 0.61
THRB P10828 1/20 0.61
RECQL P46063 1/20 0.61
RAB9A P51151 1/20 0.61
NPSR1 Q6W5P4 1/20 0.61
HSD17B10 Q99714 1/20 0.61
GFER P55789 4/20 0.46
LMNA P02545 4/20 0.46

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
SCHEMBL6219283 0.95 MAPT (0.58) MAPTALDH1A1L3MBTL1GAAKDM4E
Hydrochloric Acid SCHEMBL6220458 0.93 MAPT (0.61) MAPTALDH1A1L3MBTL1GAAKDM4E
SCHEMBL6253761 0.91 MAPT (0.62) MAPTALDH1A1L3MBTL1GAAKDM4E
SCHEMBL25900 0.91 MAPT (0.55) MAPTALDH1A1L3MBTL1GAAKDM4E
SCHEMBL33852 0.81 ALDH1A1 (0.91) MAPTALDH1A1L3MBTL1GAAKDM4E
SCHEMBL2019193 0.81 MAPT (0.53) MAPTALDH1A1L3MBTL1GAAKDM4E
SCHEMBL15652154 0.81 MAPT (0.53) MAPTALDH1A1L3MBTL1GAAKDM4E
SCHEMBL15651663 0.81 MAPT (0.53) MAPTALDH1A1L3MBTL1GAAKDM4E
SCHEMBL6260141 0.81 MAPT (0.58) MAPTALDH1A1L3MBTL1GAAKDM4E
SCHEMBL33623 0.80 AR (0.49) MAPTALDH1A1L3MBTL1GAAKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2005068431-A1 COMPOSITION FOR DYEING KERATIN FIBRES, COMPRISING AT LEAST ONE PARA-PHENYLENEDIAMINE DERIVATIVE L'OREAL (FR) 2005-07-28 WO claimed
WO-2005068431-A1 COMPOSITION FOR DYEING KERATIN FIBRES, COMPRISING AT LEAST ONE PARA-PHENYLENEDIAMINE DERIVATIVE L'OREAL (FR) 2005-07-28 WO disclosed