SCHEMBL24929033

SCHEMBL24929033

c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc4sc5c(-c6ccc(-c7cccc8sc9ccccc9c78)c7oc8ccccc8c67)cccc5c34)n2)cc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRDT Q58F21 2/20 0.37
PRKDC P78527 3/20 0.36
PIK3CD O00329 2/20 0.36
PIK3CB P42338 2/20 0.36
MAPT P10636 8/20 0.34
TSHR P16473 3/20 0.34
LMNA P02545 3/20 0.34
KMT2A Q03164 3/20 0.34
POLB P06746 2/20 0.34
HTT P42858 1/20 0.34
ALDH1A1 P00352 3/20 0.33
KDM4E B2RXH2 2/20 0.33
HPGD P15428 1/20 0.33
BRD4 O60885 1/20 0.33
PIK3CA P42336 1/20 0.33
MTOR P42345 1/20 0.33
PIK3CG P48736 1/20 0.33
KCNH2 Q12809 1/20 0.33
NPSR1 Q6W5P4 2/20 0.33
CDC14B O60729 1/20 0.33

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
SCHEMBL24930488 0.95 MAPT (0.35) BRDTPRKDCPIK3CDPIK3CBMAPT
SCHEMBL22376498 0.94 PRKDC (0.36) BRDTPRKDCPIK3CDPIK3CBMAPT
SCHEMBL24929662 0.94 PRKDC (0.40) BRDTPRKDCPIK3CDPIK3CBMAPT
SCHEMBL24930485 0.94 ALOX5 (0.39) BRDTPRKDCPIK3CDPIK3CBMAPT
SCHEMBL26217698 0.94 LIMK1 (0.38) BRDTPRKDCPIK3CDPIK3CBMAPT
SCHEMBL26217607 0.94 CDC14B (0.38) PRKDCPIK3CDPIK3CBMAPTTSHR
SCHEMBL22377391 0.94 BRDT (0.38) BRDTMAPTTSHRLMNAKMT2A
SCHEMBL24929529 0.92 ALOX5 (0.38) BRDTPRKDCPIK3CDPIK3CBMAPT
SCHEMBL22377394 0.92 ALOX5 (0.39) BRDTPRKDCPIK3CDPIK3CBMAPT
SCHEMBL26220817 0.92 LIMK1 (0.37) PRKDCPIK3CDPIK3CBMAPTTSHR

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