SCHEMBL21755378

SCHEMBL21755378

c1ccc(-n2c3ccccc3c3c2ccc2c4cc(-c5cccc6c5sc5ccc(-c7ccc(-n8c9ccccc9c9c8ccc8c%10ccccc%10n(-c%10ccccc%10)c89)cc7)cc56)ccc4n(-c4ccc(-c5ccc6sc7ccccc7c6c5)cc4)c23)cc1

nearest known ligand 0.41

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 1/20 0.41
▸ PRKDC P78527 1/20 0.35
▸ KDM4E B2RXH2 1/20 0.33
▸ ATM Q13315 1/20 0.33
▸ L3MBTL1 Q9Y468 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
SCHEMBL18505212 0.93 ALOX5 (0.41) ALOX5PRKDCKDM4EATML3MBTL1
SCHEMBL18505240 0.93 ALOX5 (0.41) ALOX5PRKDCKDM4EATML3MBTL1
SCHEMBL18505252 0.93 ALOX5 (0.43) ALOX5PRKDCKDM4EATML3MBTL1
SCHEMBL18505221 0.93 ALOX5 (0.43) ALOX5PRKDCKDM4EATML3MBTL1
SCHEMBL21914485 0.93 ALOX5 (0.36) ALOX5PRKDCKDM4EATML3MBTL1
SCHEMBL21914394 0.92 ALOX5 (0.37) ALOX5PRKDC
SCHEMBL18505239 0.92 ALOX5 (0.41) ALOX5PRKDCKDM4EATML3MBTL1
SCHEMBL18505210 0.92 ALOX5 (0.41) ALOX5PRKDCKDM4EATML3MBTL1
SCHEMBL18505225 0.91 ALOX5 (0.41) ALOX5PRKDCKDM4EATML3MBTL1
SCHEMBL18505253 0.91 ALOX5 (0.41) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10573839-B2 Organic light-emitting device SAMSUNG DISPLAY CO., LTD. (KR) 2020-02-25 — — US disclosed
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