SCHEMBL16613446

SCHEMBL16613446

CC1(C)C=c2nc(-n3c4ccccc4c4ccccc43)nc(-c3cccc4c3sc3ccccc34)c2=C1

nearest known ligand 0.34

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PARP14 Q460N5 1/20 0.34
ALOX5 P09917 1/20 0.33
PRKDC P78527 3/20 0.32
PIK3CD O00329 1/20 0.32
PIK3CB P42338 1/20 0.32
MAPT P10636 1/20 0.30
ADK P55263 1/20 0.30

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
SCHEMBL16613335 0.91 PARP14 (0.30) PARP14
SCHEMBL16613444 0.85
SCHEMBL16613418 0.83 TUBB4A (0.36) MAPT
SCHEMBL16613431 0.81 TUBB4A (0.34)
SCHEMBL16613448 0.81 KDM4E (0.38) MAPT
SCHEMBL16613341 0.80 KDM4E (0.30)
SCHEMBL16613447 0.79 DUSP3 (0.30)
SCHEMBL16613694 0.79 PARP14 (0.35) PARP14ALOX5PRKDCPIK3CDPIK3CB
SCHEMBL16613337 0.78 ENPP3 (0.35)
SCHEMBL16613498 0.77 KDM4E (0.35) MAPT

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-2015047058-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING SAME 주식회사 두산 2015-04-02 WO disclosed