SCHEMBL25964825

SCHEMBL25964825

c1ccc(-c2ccc(-n3c4ccccc4c4ccc5c6ccccc6n(-c6cccc(-c7nc(-c8ccccc8)nc(-c8cccc9c8oc8ccccc89)n7)c6)c5c43)cc2)cc1

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.38
PRKDC P78527 3/20 0.34
GGPS1 O95749 1/20 0.34
MAPT P10636 4/20 0.33
KDM4E B2RXH2 3/20 0.33
TSHR P16473 2/20 0.33
ALDH1A1 P00352 2/20 0.33
LMNA P02545 1/20 0.33
MAPK1 P28482 1/20 0.33
HSD17B10 Q99714 1/20 0.33
POLB P06746 1/20 0.33
PIK3CD O00329 1/20 0.32
PIK3CB P42338 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
ATM Q13315 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
PDE10A Q9Y233 1/20 0.31
HPGD P15428 1/20 0.31
PTGER4 P35408 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
SCHEMBL22049192 0.97 ALOX5 (0.37) ALOX5PRKDCGGPS1MAPTKDM4E
SCHEMBL24216597 0.96 ALOX5 (0.37) ALOX5PRKDCGGPS1MAPTKDM4E
SCHEMBL25964791 0.95 ALOX5 (0.39) ALOX5PRKDCGGPS1MAPTKDM4E
SCHEMBL25965143 0.94 PRKDC (0.36) ALOX5PRKDCGGPS1KDM4ETSHR
SCHEMBL17539819 0.94 ALOX5 (0.40) ALOX5PRKDCGGPS1MAPTKDM4E
SCHEMBL23602351 0.92 ALOX5 (0.35) ALOX5PRKDCGGPS1MAPTKDM4E
SCHEMBL23947353 0.92 ALOX5 (0.40) ALOX5PRKDCGGPS1MAPTKDM4E
SCHEMBL25965111 0.92 ALOX5 (0.37) ALOX5PRKDCGGPS1MAPTKDM4E
SCHEMBL19769769 0.92 ALOX5 (0.37) ALOX5PRKDCGGPS1MAPTKDM4E
SCHEMBL22049202 0.92 ALOX5 (0.37) ALOX5PRKDCGGPS1MAPTKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230255106-A1 ORGANIC ELECTROLUMINESCENT APPARATUS MERCK PATENT GMBH (DE) 2023-08-10 US disclosed
US-20230255106-A1 ORGANIC ELECTROLUMINESCENT APPARATUS MERCK PATENT GMBH (DE) 2023-08-10 US disclosed