SCHEMBL20097831

SCHEMBL20097831

c1ccc(-c2ccc3c(c2)c2ccccc2n3-c2ccc3sc4ccc(-n5c6ccccc6c6cccc(-c7cccc8c7sc7ccccc78)c65)cc4c3c2)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 1/20 0.39
▸ LIMK1 P53667 1/20 0.35
▸ PIM3 Q86V86 2/20 0.34
▸ PARP14 Q460N5 1/20 0.33
▸ PRKDC P78527 6/20 0.32
▸ PIK3CD O00329 2/20 0.32
▸ PIK3CB P42338 2/20 0.32
▸ BRD4 O60885 1/20 0.32
▸ PIK3CA P42336 1/20 0.32
▸ MTOR P42345 1/20 0.32
▸ PIK3CG P48736 1/20 0.32
▸ KCNH2 Q12809 1/20 0.32
▸ BRDT Q58F21 1/20 0.32
▸ TSPO P30536 1/20 0.31
▸ KDM4E B2RXH2 1/20 0.31
▸ ATM Q13315 1/20 0.31
▸ L3MBTL1 Q9Y468 1/20 0.31
▸ PIM1 P11309 2/20 0.30
▸ PIM2 Q9P1W9 2/20 0.30
▸ TNKS O95271 1/20 0.30

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
SCHEMBL21365741 0.94 ALOX5 (0.42) ALOX5LIMK1PIM3PARP14PRKDC
SCHEMBL20097819 0.94 ALOX5 (0.43) ALOX5LIMK1PIM3PARP14PRKDC
SCHEMBL17735772 0.92 ALOX5 (0.42) ALOX5LIMK1PIM3PARP14PRKDC
SCHEMBL25671984 0.92 PIM3 (0.39) ALOX5LIMK1PIM3TSPOKDM4E
SCHEMBL21914396 0.92 ALOX5 (0.45) ALOX5LIMK1PIM3PARP14PRKDC
SCHEMBL25940930 0.91 PIM3 (0.36) ALOX5LIMK1PIM3TSPOKDM4E
SCHEMBL25941021 0.91 PIM3 (0.35) ALOX5LIMK1PIM3TSPOKDM4E
SCHEMBL25940970 0.90 PIM3 (0.38) ALOX5LIMK1PIM3TSPOKDM4E
SCHEMBL25941018 0.90 PIM3 (0.38) ALOX5LIMK1PIM3TSPOKDM4E
SCHEMBL24986923 0.90 ALOX5 (0.36) ALOX5LIMK1PIM3PARP14PRKDC

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-9960356-B2 Organic electroluminescence device, lighting equipment and display device Konica Minolta, Inc. (JP) 2018-05-01 — — US disclosed
US-9960356-B2 Organic electroluminescence device, lighting equipment and display device Konica Minolta, Inc. (JP) 2018-05-01 — — US disclosed
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