SCHEMBL25212933

SCHEMBL25212933

CC1(C)c2ccccc2-c2ccc(-c3nc(-c4cc(-c5ccccc5)ccc4-c4ccccc4)nc(-c4cccc5c4sc4ccccc45)n3)cc21

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.39
PDK2 Q15119 4/20 0.33
PARP14 Q460N5 1/20 0.33
F9 P00740 1/20 0.32
MAPT P10636 1/20 0.32
PRKDC P78527 2/20 0.32
LIMK1 P53667 1/20 0.31
PIM3 Q86V86 2/20 0.30
TNKS O95271 1/20 0.30
TNKS2 Q9H2K2 1/20 0.30
PIM1 P11309 1/20 0.30
PIM2 Q9P1W9 1/20 0.30
ROCK1 Q13464 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
SCHEMBL22084518 0.97 ALOX5 (0.38) ALOX5PDK2PARP14F9MAPT
SCHEMBL25047185 0.97 ALOX5 (0.40) ALOX5PDK2PARP14F9MAPT
SCHEMBL23025044 0.96 ALOX5 (0.39) ALOX5PDK2PARP14F9MAPT
SCHEMBL23024856 0.96 ALOX5 (0.39) ALOX5PDK2PARP14F9MAPT
SCHEMBL23024902 0.96 ALOX5 (0.39) ALOX5PDK2PARP14F9MAPT
SCHEMBL24681764 0.96 ALOX5 (0.39) ALOX5PDK2PARP14F9MAPT
SCHEMBL23024863 0.96 ALOX5 (0.39) ALOX5PDK2PARP14F9MAPT
SCHEMBL17425580 0.96 ALOX5 (0.40) ALOX5PDK2PARP14F9MAPT
SCHEMBL30019652 0.96 ALOX5 (0.40) ALOX5PDK2PARP14F9MAPT
SCHEMBL22085298 0.96 ALOX5 (0.40) ALOX5PDK2PARP14F9MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118339941-A Mixed powder and method for producing same, method for producing organic electroluminescent element using same, method for selecting compound in mixed powder, and composition for vacuum vapor deposition 出光兴产株式会社 2024-07-12 CN disclosed
CN-117616909-A Mixed powder for organic electroluminescent element and method for producing same, method for producing organic electroluminescent element using same, method for selecting compound in mixed powder, and composition for vacuum evaporation 出光兴产株式会社 2024-02-27 CN disclosed
CN-117581654-A Mixed powder, mixed body, and method for manufacturing organic electroluminescent element 出光兴产株式会社 2024-02-20 CN disclosed
WO-2023100891-A1 SOLID MOLTEN MIXTURE, SOLID COMPOSITION, MIXED POWDER, METHOD FOR CHOOSING ORGANIC COMPOUND, METHOD FOR PRODUCING SOLID MOLTEN MIXTURE, AND METHOD FOR PRODUCING ORGANIC ELECTROLUMINESCENT ELEMENT 出光興産株式会社 2023-06-08 WO disclosed