SCHEMBL24848690

SCHEMBL24848690

c1ccc2c(-c3cccc4oc5c(ccc6c7ccccc7oc65)c34)nc(-n3c4ccccc4c4ccccc43)nc2c1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKDC P78527 3/20 0.34
PIK3CD O00329 1/20 0.34
PIK3CB P42338 1/20 0.34
ALOX5 P09917 2/20 0.34
KDM4E B2RXH2 3/20 0.33
ALDH1A1 P00352 3/20 0.33
HPGD P15428 3/20 0.33
MAPT P10636 2/20 0.33
CYP1A2 P05177 1/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
L3MBTL1 Q9Y468 2/20 0.32
GABRP O00591 2/20 0.32
GABRD O14764 2/20 0.32
GABRA1 P14867 2/20 0.32
GABRB1 P18505 2/20 0.32
GABRG2 P18507 2/20 0.32
GABRB3 P28472 2/20 0.32
GABRA5 P31644 2/20 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
SCHEMBL24848995 0.91 NPC1 (0.32) KDM4EALDH1A1HPGDMAPTCYP1A2
SCHEMBL19239345 0.89 PRKDC (0.32) PRKDCPIK3CDPIK3CBALOX5KDM4E
SCHEMBL19239349 0.89 PRKDC (0.32) PRKDCPIK3CDPIK3CBALOX5KDM4E
SCHEMBL16978585 0.87 PRKDC (0.35) PRKDCPIK3CDPIK3CBALOX5KDM4E
SCHEMBL24848658 0.86 AHR (0.34) KDM4EALDH1A1HPGDMAPTCYP1A2
SCHEMBL19239418 0.86 ALOX5 (0.42) PRKDCPIK3CDPIK3CBALOX5KDM4E
SCHEMBL15497619 0.85 ALDH1A1 (0.33) PRKDCPIK3CDPIK3CBALOX5KDM4E
SCHEMBL24848685 0.84 PRKDC (0.33) PRKDCPIK3CDPIK3CBALOX5KDM4E
SCHEMBL14756492 0.84 PRKDC (0.34) PRKDCPIK3CDPIK3CBALOX5KDM4E
SCHEMBL24849006 0.84 CYP1A2 (0.37) KDM4EALDH1A1HPGDMAPTCYP1A2

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-2023277446-A1 HETEROCYCLIC COMPOUND, ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME, AND COMPOSITION FOR ORGANIC LAYER 엘티소재주식회사 2023-01-05 WO disclosed