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SCHEMBL18518200

SCHEMBL18518200

CC1(C)c2ccccc2-c2cc3c4ccccc4n(-c4cc(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)ccc4-c4cccc5c4sc4ccccc45)c3cc21

nearest known ligand 0.36

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 1/20 0.36
▸ PRKDC P78527 1/20 0.33
▸ KDM4E B2RXH2 1/20 0.31
▸ ATM Q13315 1/20 0.31
▸ L3MBTL1 Q9Y468 1/20 0.31
▸ PARP14 Q460N5 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
SCHEMBL16282988 0.94 ALOX5 (0.38) ALOX5PRKDCKDM4EATML3MBTL1
SCHEMBL16283075 0.93 ALOX5 (0.35) ALOX5PRKDCKDM4EATML3MBTL1
SCHEMBL15337982 0.93 ALOX5 (0.35) ALOX5PRKDCKDM4EATML3MBTL1
SCHEMBL15338005 0.93 ALOX5 (0.42) ALOX5PRKDCPARP14
SCHEMBL18518198 0.93 ALOX5 (0.37) ALOX5PRKDCPARP14
SCHEMBL18518204 0.91 ALOX5 (0.36) ALOX5PRKDCKDM4EATML3MBTL1
SCHEMBL16641311 0.91 ALOX5 (0.41) ALOX5PRKDCPARP14
SCHEMBL18518765 0.90 KDM4E (0.33) KDM4EATML3MBTL1
SCHEMBL16641318 0.90 ALOX5 (0.40) ALOX5PRKDCPARP14
SCHEMBL18020795 0.89 ALOX5 (0.39) ALOX5PRKDCKDM4EATML3MBTL1

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
EP-3335254-B1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2020-04-08 — — EP disclosed
WO-2017025164-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2017-02-16 — — WO disclosed
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