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Sugi Predict / Compounds / SCHEMBL25965188

SCHEMBL25965188

SCHEMBL25965188

c1ccc(-c2nc(-c3ccc4c(c3)oc3c(-c5ccccc5)cccc34)nc(-n3c4ccccc4c4ccc5c(c6ccccc6n5-c5ccccc5)c43)n2)cc1

nearest known ligand 0.38

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ PRKDC P78527 1/20 0.34
▸ ALOX5 P09917 1/20 0.33
▸ KDM4E B2RXH2 1/20 0.32
▸ ATM Q13315 1/20 0.32
▸ L3MBTL1 Q9Y468 1/20 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
SCHEMBL25965165 0.96 PRKDC (0.34) PRKDCALOX5
SCHEMBL23602174 0.96 PRKDC (0.32) PRKDCALOX5KDM4EATML3MBTL1
SCHEMBL25965162 0.95 PRKDC (0.34) PRKDCALOX5KDM4EATML3MBTL1
SCHEMBL25965186 0.95 PRKDC (0.34) PRKDCALOX5KDM4EATML3MBTL1
SCHEMBL25965180 0.95 PRKDC (0.34) PRKDCALOX5KDM4EATML3MBTL1
SCHEMBL25965160 0.95 PRKDC (0.34) PRKDCALOX5KDM4EATML3MBTL1
SCHEMBL24914547 0.93 ALOX5 (0.38) PRKDCALOX5KDM4EATML3MBTL1
SCHEMBL25965156 0.93 PRKDC (0.36) PRKDCALOX5KDM4EATML3MBTL1
SCHEMBL19769875 0.92 ALOX5 (0.34) PRKDCALOX5KDM4EATML3MBTL1
SCHEMBL19769872 0.92 KDM4E (0.34) PRKDCALOX5KDM4EATML3MBTL1

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