SCHEMBL23823711

SCHEMBL23823711

c1ccc(-c2ccc(-c3nc(-c4ccccc4)nc(-c4cccc5oc6c(-c7cccc8c7sc7cc(-c9ccccc9)ccc78)cccc6c45)n3)cc2)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
▸ PIK3CA P42336 2/20 0.36
▸ BRD4 O60885 1/20 0.36
▸ MTOR P42345 1/20 0.36
▸ PIK3CG P48736 1/20 0.36
▸ KCNH2 Q12809 1/20 0.36
▸ BRDT Q58F21 1/20 0.36
▸ LIMK1 P53667 2/20 0.36
▸ ALOX5 P09917 3/20 0.36
▸ MAPT P10636 3/20 0.32
▸ POLB P06746 2/20 0.32
▸ TSHR P16473 2/20 0.32
▸ LMNA P02545 1/20 0.32
▸ HTT P42858 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ PI4KA P42356 1/20 0.31
▸ PI4KB Q9UBF8 1/20 0.31
▸ PIM1 P11309 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
SCHEMBL25459058 0.94 ALOX5 (0.37) PRKDCPIK3CDPIK3CBPIK3CABRD4
SCHEMBL22403580 0.94 LIMK1 (0.36) PRKDCPIK3CDPIK3CBPIK3CABRD4
SCHEMBL25458974 0.93 ALOX5 (0.40) PRKDCPIK3CDPIK3CBPIK3CABRD4
SCHEMBL24217203 0.93 PRKDC (0.44) PRKDCPIK3CDPIK3CBPIK3CABRD4
SCHEMBL23349683 0.92 ALOX5 (0.39) PRKDCPIK3CDPIK3CBPIK3CABRD4
SCHEMBL25458970 0.92 PRKDC (0.38) PRKDCPIK3CDPIK3CBPIK3CABRD4
SCHEMBL22403309 0.92 ALOX5 (0.38) PRKDCPIK3CDPIK3CBPIK3CABRD4
SCHEMBL24217208 0.92 PRKDC (0.42) PRKDCPIK3CDPIK3CBPIK3CABRD4
SCHEMBL25458977 0.90 ALOX5 (0.40) PRKDCPIK3CALIMK1ALOX5MAPT
SCHEMBL24217160 0.90 PRKDC (0.45) PRKDCPIK3CDPIK3CBPIK3CABRD4

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230157151-A1 ORGANIC ELECTROLUMINESCENT APPARATUS MERCK PATENT GMBH (DE) 2023-05-18 — — US disclosed
US-20230157151-A1 ORGANIC ELECTROLUMINESCENT APPARATUS MERCK PATENT GMBH (DE) 2023-05-18 — — US disclosed
WO-2021180625-A1 ORGANIC ELECTROLUMINESCENT APPARATUS MERCK PATENT GMBH (DE) 2021-09-16 — — WO disclosed
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