SCHEMBL9408736

SCHEMBL9408736

[CH2]c1cc(C)cc(-n2nc3ccccc3n2)c1O

nearest known ligand 0.68

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 9/20 0.68
RAB9A P51151 9/20 0.68
POLB P06746 2/20 0.59
LMNA P02545 1/20 0.59
SMN1; SMN2 Q16637 6/20 0.47
ALDH1A1 P00352 5/20 0.47
KDM4E B2RXH2 5/20 0.46
MAPT P10636 5/20 0.40
HPGD P15428 5/20 0.40
TDP1 Q9NUW8 2/20 0.40
NPSR1 Q6W5P4 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
THRB P10828 1/20 0.39
IGF2BP2 Q9Y6M1 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
HTT P42858 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
SCHEMBL9408821 0.84 NPC1 (0.56) NPC1RAB9APOLBLMNASMN1; SMN2
SCHEMBL7703339 0.83 NPC1 (0.71) NPC1RAB9APOLBLMNASMN1; SMN2
SCHEMBL1275936 0.83 NPC1 (0.71) NPC1RAB9APOLBLMNASMN1; SMN2
SCHEMBL29489567 0.83 NPC1 (0.71) NPC1RAB9APOLBLMNASMN1; SMN2
SCHEMBL110113 0.83 NPC1 (0.71) NPC1RAB9APOLBLMNASMN1; SMN2
SCHEMBL13716942 0.81 NPC1 (0.64) NPC1RAB9APOLBLMNASMN1; SMN2
SCHEMBL10598824 0.81 NPC1 (1.00) NPC1RAB9APOLBLMNASMN1; SMN2
SCHEMBL18375849 0.81 NPC1 (0.68) NPC1RAB9APOLBLMNASMN1; SMN2
SCHEMBL105385 0.81 NPC1 (0.68) NPC1RAB9APOLBLMNASMN1; SMN2
SCHEMBL27164725 0.81 NPC1 (0.46) NPC1RAB9APOLBLMNASMN1; SMN2

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