SCHEMBL29068479

SCHEMBL29068479

CCCCNc1cccc2c1Cc1ccccc1-2

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.52
RAB9A P51151 2/20 0.52
PNMT P11086 1/20 0.44
ALDH1A1 P00352 2/20 0.40
APAF1 O14727 1/20 0.40
BCHE P06276 2/20 0.39
ACHE P22303 2/20 0.39
BACE1 P56817 1/20 0.39
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
POLB P06746 2/20 0.39
RGS12 O14924 1/20 0.39
USP2 O75604 1/20 0.39
MAPT P10636 1/20 0.39
MAPK1 P28482 1/20 0.39
HTT P42858 1/20 0.39
ATM Q13315 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
TLR9 Q9NR96 1/20 0.39
TDP1 Q9NUW8 1/20 0.39

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
SCHEMBL3259665 0.95 NPC1 (0.51) NPC1RAB9APNMTALDH1A1APAF1
SCHEMBL30203895 0.94 NPC1 (0.50) NPC1RAB9APNMTALDH1A1BCHE
SCHEMBL9348648 0.85 NPC1 (0.44) NPC1RAB9AALDH1A1APAF1BCHE
SCHEMBL8523597 0.84 NPC1 (0.58) NPC1RAB9APNMTALDH1A1BCHE
SCHEMBL11935616 0.82 PNMT (0.49) NPC1RAB9APNMTBCHEACHE
SCHEMBL20640485 0.80 PNMT (0.40) NPC1RAB9APNMTALDH1A1APAF1
SCHEMBL29171790 0.78 NPC1 (0.54) NPC1RAB9APNMTALDH1A1BCHE
SCHEMBL13564926 0.77 NPC1 (0.45) NPC1RAB9APNMTALDH1A1BCHE
SCHEMBL11941130 0.77 NPC1 (0.45) NPC1RAB9APNMTALDH1A1BCHE
SCHEMBL28791770 0.77 MEN1 (0.42) NPC1RAB9AALDH1A1BCHEACHE

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
CN-116745115-A Laminate, card and case 索尼集团公司 2023-09-12 CN disclosed