SCHEMBL21709347

SCHEMBL21709347

c1ccc(-n2c3ccccc3c3cc(-c4cc5[nH]c6ccccc6c5c5sc6ccccc6c45)ccc32)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TNKS O95271 2/20 0.40
▸ TNKS2 Q9H2K2 2/20 0.40
▸ KDM4E B2RXH2 4/20 0.38
▸ ATM Q13315 1/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ MAP3K9 P80192 4/20 0.35
▸ MAP3K11 Q16584 4/20 0.35
▸ CDK4 P11802 1/20 0.35
▸ CCND1 P24385 1/20 0.35
▸ MEN1 O00255 2/20 0.35
▸ KMT2A Q03164 2/20 0.35
▸ MAPT P10636 1/20 0.35
▸ RAB9A P51151 1/20 0.35
▸ NTRK1 P04629 1/20 0.33
▸ MAP3K10 Q02779 1/20 0.33
▸ AHR P35869 1/20 0.32
▸ HTT P42858 4/20 0.32
▸ NPSR1 Q6W5P4 2/20 0.32
▸ HPGD P15428 2/20 0.32
▸ HCRTR1 O43613 1/20 0.32

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
SCHEMBL21708984 0.85 ATM (0.43) KDM4EATML3MBTL1MEN1KMT2A
SCHEMBL15860355 0.83 KDM4E (0.46) KDM4EATML3MBTL1MAP3K9MAP3K11
SCHEMBL21709326 0.82 MEN1 (0.40) TNKSTNKS2KDM4EATML3MBTL1
SCHEMBL20175465 0.81 ATM (0.42) KDM4EATML3MBTL1MEN1KMT2A
SCHEMBL8819322 0.81 KDM4E (0.39) TNKSTNKS2KDM4EATML3MBTL1
SCHEMBL15860359 0.80 KDM4E (0.43) KDM4EATML3MBTL1MAP3K9MAP3K11
SCHEMBL15337951 0.80 KDM4E (0.38) TNKSTNKS2KDM4EATML3MBTL1
SCHEMBL15860311 0.79 KDM4E (0.42) KDM4EATML3MBTL1MAP3K9MAP3K11
SCHEMBL23788750 0.79 ATM (0.44) KDM4EATML3MBTL1MEN1KMT2A
SCHEMBL15860327 0.79 KDM4E (0.44) KDM4EATML3MBTL1MAP3K9MAP3K11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2020032424-A1 ORGANIC ELECTRONIC ELEMENT COMPRISING, AS HOST MATERIAL, MIXTURE OF DIFFERENT KINDS OF COMPOUNDS, AND ELECTRONIC DEVICE THEREOF 덕산네오룩스 주식회사 2020-02-13 — — WO disclosed
WO-2020032447-A1 ORGANIC ELECTRONIC ELEMENT COMPRISING, AS HOST MATERIAL, MIXTURE OF DIFFERENT KINDS OF COMPOUNDS, AND ELECTRONIC DEVICE THEREOF 덕산네오룩스 주식회사 2020-02-13 — — WO disclosed
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