SCHEMBL10498902

SCHEMBL10498902

N#CCCNc1ccc(O)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 6/20 0.59
ALDH1A1 P00352 4/20 0.59
HTT P42858 1/20 0.55
THRB P10828 3/20 0.50
APP P05067 2/20 0.44
L3MBTL1 Q9Y468 4/20 0.40
MAPT P10636 4/20 0.40
MEN1 O00255 2/20 0.40
POLB P06746 2/20 0.40
HPGD P15428 2/20 0.40
ALOX15 P16050 2/20 0.40
MAPK1 P28482 2/20 0.40
CASP1 P29466 2/20 0.40
BLM P54132 2/20 0.40
KMT2A Q03164 2/20 0.40
HSD17B10 Q99714 2/20 0.40
KDM4E B2RXH2 2/20 0.40
AGER Q15109 1/20 0.40
HSP90AA1 P07900 1/20 0.40
HSP90AB1 P08238 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
SCHEMBL11252528 0.89 GAA (0.70) GAAALDH1A1HTTTHRBMAPT
SCHEMBL10499416 0.86 GAA (0.46) GAAALDH1A1HTTTHRBAPP
SCHEMBL10498867 0.85 GAA (0.45) GAAALDH1A1HTTTHRBAPP
SCHEMBL10499055 0.85 GAA (0.45) GAAALDH1A1HTTTHRBAPP
SCHEMBL10499081 0.85 GAA (0.45) GAAALDH1A1HTTTHRBAPP
SCHEMBL10499063 0.85 GAA (0.45) GAAALDH1A1HTTTHRBAPP
SCHEMBL5028293 0.81 GAA (0.61) GAAALDH1A1HTTTHRBMAPT
SCHEMBL1161861 0.79 APP (0.55) GAAALDH1A1THRBAPPL3MBTL1
SCHEMBL11142878 0.79 GAA (0.59) GAAALDH1A1HTTTHRBAPP
SCHEMBL2705170 0.79 GAA (0.59) GAAALDH1A1HTTTHRBL3MBTL1

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
US-4835180-A N-(ω-cyanoalkyl)aminophenols and use as inhibitors of lipoxygenase activity STERLING DRUG INC. (US) 1989-05-30 US disclosed
EP-0262618-A2 N-(omega)-cyanoalkyl)aminophenols, and their preparation STERLING DRUG INC. (US) 1988-04-06 EP disclosed