SCHEMBL29236170

SCHEMBL29236170

CCCCOc1ccc(-c2ncnc(-c3ccc(C)cc3C)n2)c(O)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.44
RAB9A P51151 3/20 0.44
ALDH1A1 P00352 2/20 0.44
MEN1 O00255 1/20 0.44
GAA P10253 1/20 0.44
MAPT P10636 1/20 0.44
KMT2A Q03164 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
LTA4H P09960 2/20 0.39
NR5A1 Q13285 1/20 0.39
ACACB O00763 1/20 0.39
ACACA Q13085 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
TP53 P04637 1/20 0.39
POLB P06746 1/20 0.39
NFKB1 P19838 1/20 0.39
MAPK1 P28482 1/20 0.39
NFKB2 Q00653 1/20 0.39
RELA Q04206 1/20 0.39
PLK1 P53350 2/20 0.38

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
SCHEMBL29236180 0.96 NR5A1 (0.46) NPC1RAB9AALDH1A1MEN1GAA
SCHEMBL3421399 0.96 NR5A1 (0.46) NPC1RAB9AALDH1A1MEN1GAA
SCHEMBL1243194 0.95 ACACB (0.44) NPC1RAB9AALDH1A1MEN1GAA
SCHEMBL8911423 0.94 NR5A1 (0.37) NPC1RAB9AALDH1A1MEN1GAA
SCHEMBL29357244 0.94 NPC1 (0.47) NPC1RAB9AALDH1A1MEN1GAA
SCHEMBL30643197 0.94 NPC1 (0.47) NPC1RAB9AALDH1A1MEN1GAA
SCHEMBL22714144 0.94 NPC1 (0.47) NPC1RAB9AALDH1A1MEN1GAA
SCHEMBL3226120 0.94 NPC1 (0.47) NPC1RAB9AALDH1A1MEN1GAA
SCHEMBL14363839 0.92 NPC1 (0.46) NPC1RAB9AALDH1A1MEN1GAA
SCHEMBL45412 0.90 NR5A1 (0.49) NPC1RAB9AALDH1A1MEN1GAA

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-118235072-A Optical film and polarizing plate 东曹株式会社 2024-06-21 CN disclosed