SCHEMBL31139211

SCHEMBL31139211

c1ccc(-c2ccc(-c3ccccc3)c(-c3cccc4c3[nH]c3ccccc34)c2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PARP14 Q460N5 12/20 0.47
▸ HTT P42858 2/20 0.46
▸ SMN1; SMN2 Q16637 2/20 0.46
▸ HPGD P15428 1/20 0.46
▸ MAPK1 P28482 1/20 0.46
▸ HTR2B P41595 1/20 0.45
▸ HTR5A P47898 1/20 0.45
▸ TDO2 P48775 1/20 0.45
▸ MEN1 O00255 1/20 0.45
▸ APAF1 O14727 1/20 0.45
▸ NPC1 O15118 1/20 0.45
▸ LMNA P02545 1/20 0.45
▸ MAPT P10636 1/20 0.45
▸ THRB P10828 1/20 0.45
▸ XBP1 P17861 1/20 0.45
▸ PTBP1 P26599 1/20 0.45
▸ RAB9A P51151 1/20 0.45
▸ GALK1 P51570 1/20 0.45
▸ BLM P54132 1/20 0.45
▸ SMAD3 P84022 1/20 0.45

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
SCHEMBL28380903 1.00 PARP14 (0.47) PARP14HTTSMN1; SMN2HPGDMAPK1
SCHEMBL2777662 0.91 CDK4 (0.47) PARP14HTTSMN1; SMN2HPGDMAPK1
SCHEMBL23154655 0.89 PARP14 (0.40) PARP14HTTSMN1; SMN2HPGDMAPK1
SCHEMBL31275984 0.89 PARP14 (0.52) PARP14HTTSMN1; SMN2HPGDMAPK1
SCHEMBL190688 0.89 PARP14 (0.52) PARP14HTTSMN1; SMN2HPGDMAPK1
SCHEMBL192834 0.89 PARP14 (0.52) PARP14HTTSMN1; SMN2HPGDMAPK1
SCHEMBL30021807 0.89 PARP14 (0.52) PARP14HTTSMN1; SMN2HPGDMAPK1
SCHEMBL29268781 0.89 PARP14 (0.52) PARP14HTTSMN1; SMN2HPGDMAPK1
SCHEMBL29832330 0.89 PARP14 (0.52) PARP14HTTSMN1; SMN2HPGDMAPK1
SCHEMBL27947473 0.89 CDK4 (0.53) PARP14HTTSMN1; SMN2HPGDMAPK1

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-111048697-B Organic electroluminescent blue light emitting device 三星显示有限公司 2024-08-20 — — CN disclosed
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