SCHEMBL29436282

SCHEMBL29436282

c1ccc(-c2ccccc2-n2c3ccccc3c3cc(-c4ccc5[nH]c6ccccc6c5c4)ccc32)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.39
MAPK1 P28482 1/20 0.39
HTT P42858 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
AHR P35869 1/20 0.39
KIF11 P52732 3/20 0.38
ALDH1A1 P00352 3/20 0.36
HSD17B10 Q99714 2/20 0.36
GPR3 P46089 1/20 0.36
KDM4E B2RXH2 2/20 0.36
ATM Q13315 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
MEN1 O00255 1/20 0.35
MAPT P10636 1/20 0.35
KMT2A Q03164 1/20 0.35
TLR9 Q9NR96 1/20 0.35
TLR8 Q9NR97 1/20 0.35
TLR7 Q9NYK1 1/20 0.35
CDK4 P11802 2/20 0.35
CCND1 P24385 2/20 0.35

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
SCHEMBL262275 1.00 HPGD (0.39) HPGDMAPK1HTTSMN1; SMN2AHR
SCHEMBL262826 0.97 HPGD (0.38) HPGDMAPK1HTTSMN1; SMN2AHR
SCHEMBL263342 0.91 AHR (0.44) HPGDMAPK1HTTSMN1; SMN2AHR
Carbazole SCHEMBL27775503 0.89 ALDH1A1 (0.45) HPGDMAPK1HTTSMN1; SMN2AHR
SCHEMBL26048345 0.89 HPGD (0.38) HPGDMAPK1HTTSMN1; SMN2AHR
SCHEMBL26057971 0.88 HTR2B (0.39) HPGDAHRKIF11ALDH1A1HSD17B10
SCHEMBL263355 0.88 KDM4E (0.39) HPGDMAPK1HTTSMN1; SMN2AHR
SCHEMBL18779494 0.88 KDM4E (0.46) ALDH1A1HSD17B10KDM4EATML3MBTL1
SCHEMBL31592719 0.88 KDM4E (0.46) ALDH1A1HSD17B10KDM4EATML3MBTL1
SCHEMBL24686509 0.87 HPGD (0.39) HPGDMAPK1HTTSMN1; SMN2AHR

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-2022055155-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME 엘티소재주식회사 2022-03-17 WO disclosed