SCHEMBL17952782

SCHEMBL17952782

c1ccc(-n2c3ccccc3c3cc(-n4c5ccccc5c5ccccc54)ccc32)c(-c2ccncc2-c2cnccc2-c2ccccc2-n2c3ccccc3c3cc(-n4c5ccccc5c5ccccc54)ccc32)c1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ IDO1 P14902 2/20 0.37
▸ KDM4E B2RXH2 1/20 0.37
▸ ATM Q13315 1/20 0.37
▸ L3MBTL1 Q9Y468 1/20 0.37
▸ MAOA P21397 5/20 0.34
▸ MAOB P27338 5/20 0.34
▸ ACHE P22303 1/20 0.34
▸ CYP1A2 P05177 3/20 0.34
▸ CYP17A1 P05093 2/20 0.34
▸ ALDH1A1 P00352 1/20 0.33
▸ METAP2 P50579 1/20 0.33
▸ DUSP3 P51452 1/20 0.32
▸ NPY5R Q15761 1/20 0.32
▸ RAC2 P15153 1/20 0.32
▸ RAC3 P60763 1/20 0.32
▸ CDC42 P60953 1/20 0.32
▸ RAC1 P63000 1/20 0.32
▸ SLC6A2 P23975 1/20 0.31
▸ TOP2A P11388 1/20 0.31
▸ MAPK9 P45984 1/20 0.31

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
SCHEMBL17952788 1.00 IDO1 (0.37) IDO1KDM4EATML3MBTL1MAOA
SCHEMBL21692024 0.89 KDM4E (0.41) IDO1KDM4EATML3MBTL1MAOA
SCHEMBL17952974 0.89 KDM4E (0.41) IDO1KDM4EATML3MBTL1MAOA
SCHEMBL17952924 0.89 KDM4E (0.41) IDO1KDM4EATML3MBTL1MAOA
SCHEMBL17952923 0.89 KDM4E (0.41) IDO1KDM4EATML3MBTL1MAOA
SCHEMBL17952778 0.89 IDO1 (0.43) IDO1KDM4EATML3MBTL1MAOA
SCHEMBL19238254 0.87 CYP1A2 (0.33) KDM4EATML3MBTL1MAOAMAOB
SCHEMBL19238241 0.87 CYP1A2 (0.33) KDM4EATML3MBTL1MAOAMAOB
SCHEMBL23373421 0.86 KDM4E (0.48) IDO1KDM4EATML3MBTL1CYP1A2
SCHEMBL23358304 0.86 KDM4E (0.48) IDO1KDM4EATML3MBTL1CYP1A2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3247771-B1 PYRIDINES AND DERIVATIVES THEREOF AS COMPONENTS FOR USE IN OPTOELECTRONIC COMPONENTS CYNORA GMBH (DE) 2020-06-10 — — EP disclosed
US-10544361-B2 Pyridines and derivatives thereof as components for use in optoelectronic components CYNORA GMBH (DE) 2020-01-28 — — US disclosed
WO-2016116517-A1 PYRIDINES AND DERIVATIVES THEREOF AS COMPONENTS FOR USE IN OPTOELECTRONIC COMPONENTS CYNORA GMBH (DE) 2016-07-28 — — WO disclosed
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