SCHEMBL24929455

SCHEMBL24929455

c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc4oc5c(-c6ccc(-c7cccc8sc9ccccc9c78)c7c6sc6ccccc67)cccc5c34)n2)cc1

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
BRDT Q58F21 2/20 0.38
PRKDC P78527 14/20 0.36
PIK3CD O00329 2/20 0.36
PIK3CB P42338 2/20 0.36
BRD4 O60885 1/20 0.32
PIK3CA P42336 1/20 0.32
MTOR P42345 1/20 0.32
PIK3CG P48736 1/20 0.32
KCNH2 Q12809 1/20 0.32
MAPT P10636 2/20 0.32
LMNA P02545 1/20 0.32
POLB P06746 1/20 0.32
TSHR P16473 1/20 0.32
HTT P42858 1/20 0.32
KMT2A Q03164 1/20 0.32
LIMK1 P53667 1/20 0.32
ALOX5 P09917 1/20 0.32
ALDH1A1 P00352 1/20 0.31
HPGD P15428 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
SCHEMBL24929393 0.97 BRDT (0.37) BRDTPRKDCPIK3CDPIK3CBBRD4
SCHEMBL24929442 0.94 PRKDC (0.42) BRDTPRKDCPIK3CDPIK3CBBRD4
SCHEMBL24929368 0.94 ALOX5 (0.39) BRDTPRKDCPIK3CDPIK3CBBRD4
SCHEMBL24929366 0.94 PRKDC (0.36) BRDTPRKDCPIK3CDPIK3CBBRD4
SCHEMBL26215989 0.94 PRKDC (0.35) BRDTPRKDCPIK3CDPIK3CBBRD4
SCHEMBL26216011 0.94 PRKDC (0.37) BRDTPRKDCPIK3CDPIK3CBBRD4
SCHEMBL24217371 0.94 BRDT (0.42) BRDTPRKDCPIK3CDPIK3CBMAPT
SCHEMBL24929529 0.93 ALOX5 (0.38) BRDTPRKDCPIK3CDPIK3CBBRD4
SCHEMBL26214601 0.93 LIMK1 (0.36) BRDTPRKDCPIK3CDPIK3CBBRD4
SCHEMBL24929013 0.92 ALOX5 (0.39) BRDTPRKDCPIK3CDPIK3CBBRD4

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-2023008795-A1 HETEROCYCLIC COMPOUND, ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME, AND COMPOSITION FOR ORGANIC LAYER 엘티소재주식회사 2023-02-02 WO disclosed