SCHEMBL31503579

SCHEMBL31503579

CC1(C)OB(c2ccc3nc(-c4ccccc4)cnc3c2)OC1(C)C

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TLR9 Q9NR96 1/20 0.52
NPC1 O15118 6/20 0.51
RAB9A P51151 5/20 0.51
SMN1; SMN2 Q16637 3/20 0.51
LPL P06858 2/20 0.51
LIPG Q9Y5X9 2/20 0.51
PDGFRB P09619 1/20 0.51
KDR P35968 1/20 0.51
FLT3 P36888 1/20 0.51
ALDH1A1 P00352 1/20 0.48
GLA P06280 1/20 0.48
GAA P10253 1/20 0.48
MAPT P10636 1/20 0.48
HDAC6 Q9UBN7 1/20 0.48
DGAT1 O75907 1/20 0.46
BCHE P06276 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
SCHEMBL7603285 0.92 LPL (0.47) TLR9NPC1RAB9ASMN1; SMN2LPL
SCHEMBL7601941 0.86 LPL (0.47) NPC1RAB9ASMN1; SMN2LPLLIPG
SCHEMBL398811 0.82 LIPG (0.55) NPC1RAB9ASMN1; SMN2LPLLIPG
SCHEMBL18943269 0.81 LIPG (0.54) NPC1RAB9ASMN1; SMN2LPLLIPG
SCHEMBL3644174 0.81 LIPG (0.57) TLR9NPC1RAB9ASMN1; SMN2LPL
SCHEMBL400579 0.79 LIPG (0.51) NPC1RAB9ASMN1; SMN2LPLLIPG
SCHEMBL20588048 0.79 LIPG (0.59) NPC1RAB9ASMN1; SMN2LPLLIPG
SCHEMBL400453 0.78 LIPG (0.50) NPC1RAB9ASMN1; SMN2LPLLIPG
SCHEMBL12006202 0.78 LIPG (0.50) NPC1RAB9ASMN1; SMN2LPLLIPG
SCHEMBL15109046 0.78 LPL (0.44) NPC1RAB9ASMN1; SMN2LPLLIPG

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
WO-2025084253-A1 CARBAZOLE COMPOUND AND ORGANIC ELECTROLUMINESCENT ELEMENT 保土谷化学工業株式会社 2025-04-24 WO disclosed