SCHEMBL24929552

SCHEMBL24929552

c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc4c(c3)oc3cccc(-c5ccc(-c6cccc7c6sc6ccccc67)c6oc7ccccc7c56)c34)n2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKDC P78527 8/20 0.41
ALOX5 P09917 3/20 0.39
PIK3CD O00329 2/20 0.39
PIK3CB P42338 2/20 0.39
BRD4 O60885 1/20 0.37
PIK3CA P42336 1/20 0.37
MTOR P42345 1/20 0.37
PIK3CG P48736 1/20 0.37
KCNH2 Q12809 1/20 0.37
BRDT Q58F21 1/20 0.37
ESR2 Q92731 1/20 0.34
MAPT P10636 4/20 0.33
POLB P06746 2/20 0.33
TSHR P16473 2/20 0.33
LMNA P02545 1/20 0.33
HTT P42858 1/20 0.33
KMT2A Q03164 1/20 0.33
PARP14 Q460N5 1/20 0.33
ALDH1A1 P00352 2/20 0.32
HPGD P15428 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
SCHEMBL22376505 0.95 PRKDC (0.40) PRKDCALOX5PIK3CDPIK3CBBRD4
SCHEMBL22375865 0.95 PRKDC (0.40) PRKDCALOX5PIK3CDPIK3CBBRD4
SCHEMBL22376467 0.95 PRKDC (0.40) PRKDCALOX5PIK3CDPIK3CBBRD4
SCHEMBL23349627 0.94 PRKDC (0.43) PRKDCALOX5PIK3CDPIK3CBBRD4
SCHEMBL22760652 0.94 PRKDC (0.45) PRKDCALOX5PIK3CDPIK3CBBRD4
SCHEMBL23349630 0.93 PRKDC (0.43) PRKDCALOX5PIK3CDPIK3CBBRD4
SCHEMBL26194121 0.93 PRKDC (0.43) PRKDCALOX5PIK3CDPIK3CBBRD4
SCHEMBL26192771 0.93 PRKDC (0.44) PRKDCALOX5PIK3CDPIK3CBBRD4
SCHEMBL22760380 0.93 PRKDC (0.44) PRKDCALOX5PIK3CDPIK3CBBRD4
SCHEMBL22375880 0.92 PRKDC (0.39) PRKDCALOX5PIK3CDPIK3CBBRD4

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