SCHEMBL23819376

SCHEMBL23819376

c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc4oc5c(-c6cccc7ccc8c9ccccc9sc8c67)cccc5c34)n2)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PRKDC P78527 6/20 0.38
▸ PIK3CD O00329 2/20 0.38
▸ PIK3CB P42338 2/20 0.38
▸ BRDT Q58F21 2/20 0.35
▸ BRD4 O60885 1/20 0.35
▸ PIK3CA P42336 1/20 0.35
▸ MTOR P42345 1/20 0.35
▸ PIK3CG P48736 1/20 0.35
▸ KCNH2 Q12809 1/20 0.35
▸ ALOX5 P09917 1/20 0.34
▸ MAPT P10636 5/20 0.33
▸ ALDH1A1 P00352 4/20 0.33
▸ TSHR P16473 3/20 0.33
▸ KDM4E B2RXH2 2/20 0.33
▸ HPGD P15428 2/20 0.33
▸ HSD17B10 Q99714 2/20 0.33
▸ TP53 P04637 1/20 0.33
▸ NFKB1 P19838 1/20 0.33
▸ MAPK1 P28482 1/20 0.33
▸ NFKB2 Q00653 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
SCHEMBL23816358 0.93 PRKDC (0.36) PRKDCPIK3CDPIK3CBBRDTBRD4
SCHEMBL23819427 0.92 PRKDC (0.40) PRKDCPIK3CDPIK3CBBRDTBRD4
SCHEMBL24217160 0.91 PRKDC (0.45) PRKDCPIK3CDPIK3CBBRDTBRD4
SCHEMBL24216050 0.90 PRKDC (0.44) PRKDCPIK3CDPIK3CBBRDTBRD4
SCHEMBL24123410 0.90 ALOX5 (0.36) PRKDCPIK3CDPIK3CBALOX5MAPT
SCHEMBL24034626 0.90 PRKDC (0.35) PRKDCPIK3CDPIK3CBBRDTBRD4
SCHEMBL23819372 0.89 CYP1A1 (0.37) PRKDCPIK3CDPIK3CBBRDTMAPT
SCHEMBL24217203 0.89 PRKDC (0.44) PRKDCPIK3CDPIK3CBBRDTBRD4
SCHEMBL24230717 0.89 PRKDC (0.43) PRKDCPIK3CDPIK3CBBRDTBRD4
SCHEMBL22329580 0.89 PRKDC (0.41) PRKDCPIK3CDPIK3CBBRDTBRD4

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-2021182833-A1 NOVEL COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE USING SAME 주식회사 엘지화학 2021-09-16 — — WO disclosed
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