SCHEMBL24929393

SCHEMBL24929393

c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc4c3oc3cccc(-c5ccc(-c6cccc7sc8ccccc8c67)c6sc7ccccc7c56)c34)n2)cc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRDT Q58F21 2/20 0.37
LIMK1 P53667 1/20 0.34
PRKDC P78527 8/20 0.34
PIK3CD O00329 2/20 0.34
PIK3CB P42338 2/20 0.34
MAPT P10636 6/20 0.34
KDM4E B2RXH2 3/20 0.33
ALDH1A1 P00352 3/20 0.33
POLB P06746 2/20 0.33
NPSR1 Q6W5P4 1/20 0.33
TSHR P16473 4/20 0.32
LMNA P02545 2/20 0.32
HTT P42858 1/20 0.32
KMT2A Q03164 1/20 0.32
MAPK1 P28482 2/20 0.31
HSD17B10 Q99714 2/20 0.31
HPGD P15428 2/20 0.31
TP53 P04637 1/20 0.31
NFKB1 P19838 1/20 0.31
NFKB2 Q00653 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
SCHEMBL24929455 0.97 BRDT (0.38) BRDTLIMK1PRKDCPIK3CDPIK3CB
SCHEMBL26214601 0.96 LIMK1 (0.36) BRDTLIMK1PRKDCPIK3CDPIK3CB
SCHEMBL26214547 0.95 MAPT (0.35) BRDTLIMK1PRKDCPIK3CDPIK3CB
SCHEMBL26762952 0.94 LIMK1 (0.34) BRDTLIMK1PRKDCPIK3CDPIK3CB
SCHEMBL26225173 0.94 LIMK1 (0.34) BRDTLIMK1PRKDCPIK3CDPIK3CB
SCHEMBL24215901 0.93 BRDT (0.40) BRDTLIMK1PRKDCPIK3CDPIK3CB
SCHEMBL24929013 0.93 ALOX5 (0.39) BRDTPRKDCPIK3CDPIK3CBMAPT
SCHEMBL26762944 0.93 ALOX5 (0.34) BRDTLIMK1PRKDCPIK3CDPIK3CB
SCHEMBL26215989 0.93 PRKDC (0.35) BRDTLIMK1PRKDCPIK3CDPIK3CB
SCHEMBL26216011 0.93 PRKDC (0.37) BRDTLIMK1PRKDCPIK3CDPIK3CB

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