SCHEMBL9408769

SCHEMBL9408769

NCc1cc(Cl)cc(-n2nc3ccccc3n2)c1O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.51
RAB9A P51151 3/20 0.51
LMNA P02545 3/20 0.41
POLB P06746 3/20 0.40
ALDH1A1 P00352 5/20 0.37
HTT P42858 1/20 0.37
MEN1 O00255 3/20 0.34
KMT2A Q03164 3/20 0.34
GFER P55789 1/20 0.34
KDM4E B2RXH2 6/20 0.34
HPGD P15428 3/20 0.34
CYP1A2 P05177 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
PNMT P11086 1/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
GAA P10253 1/20 0.33
HSP90AA1 P07900 1/20 0.33
LOXL2 Q9Y4K0 1/20 0.33
GABRA1 P14867 1/20 0.33

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
SCHEMBL9408798 0.84 NPC1 (0.49) NPC1RAB9ALMNAPOLBALDH1A1
SCHEMBL508460 0.82 NPC1 (0.62) NPC1RAB9ALMNAPOLBALDH1A1
Hydrochloric Acid SCHEMBL8372133 0.81 NPC1 (0.61) NPC1RAB9ALMNAPOLBALDH1A1
SCHEMBL9408808 0.81 NPC1 (0.43) NPC1RAB9ALMNAPOLBALDH1A1
SCHEMBL563223 0.80 NPC1 (0.71) NPC1RAB9ALMNAPOLBALDH1A1
SCHEMBL9408883 0.79 NPC1 (0.40) NPC1RAB9ALMNAPOLBALDH1A1
SCHEMBL9408834 0.79 NPC1 (0.45) NPC1RAB9ALMNAPOLBALDH1A1
SCHEMBL9408768 0.79 NPC1 (0.45) NPC1RAB9ALMNAPOLBALDH1A1
SCHEMBL9408845 0.79 NPC1 (0.42) NPC1RAB9ALMNAPOLBALDH1A1
SCHEMBL9408926 0.78 NPC1 (0.42) NPC1RAB9ALMNAPOLBALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0593936-A1 N-[2-hydroxy-3-(2H-benzotriazol-2-yl)benzyl]oxamides as light stabilisers ELF ATOCHEM NORTH AMERICA, INC. (US) 1994-04-27 EP disclosed