SCHEMBL27320563

SCHEMBL27320563

c1ccc(N(c2ccccc2-c2cccc3c2oc2cc4ccccc4cc23)c2cccc3oc4ccccc4c23)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.39
PRKDC P78527 4/20 0.33
PIK3CD O00329 1/20 0.32
PIK3CB P42338 1/20 0.32
AHR P35869 1/20 0.31
KDM4E B2RXH2 1/20 0.31
MEN1 O00255 1/20 0.31
CYP3A4 P08684 1/20 0.31
ALPI P09923 1/20 0.31
GAA P10253 1/20 0.31
MAPT P10636 1/20 0.31
PKM P14618 1/20 0.31
HPGD P15428 1/20 0.31
CASP3 P42574 1/20 0.31
RECQL P46063 1/20 0.31
BLM P54132 1/20 0.31
CASP7 P55210 1/20 0.31
CASP6 P55212 1/20 0.31
KMT2A Q03164 1/20 0.31
MCL1 Q07820 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
SCHEMBL27320561 0.94 ALOX5 (0.38) ALOX5PRKDCPIK3CDPIK3CBCDC14B
SCHEMBL27320224 0.91 ALOX5 (0.43) ALOX5PRKDCPIK3CDPIK3CBAHR
SCHEMBL27320553 0.91 ALOX5 (0.37) ALOX5PRKDCPIK3CDPIK3CBKDM4E
SCHEMBL27320921 0.90 ALOX5 (0.34) ALOX5PRKDCKDM4ECYP3A4MAPT
SCHEMBL27320555 0.90 ALOX5 (0.38) ALOX5PRKDCPIK3CDPIK3CBAHR
SCHEMBL27320560 0.90 ALOX5 (0.40) ALOX5PRKDCPIK3CDPIK3CBAHR
SCHEMBL27330322 0.90 ALOX5 (0.39) ALOX5PRKDCPIK3CDPIK3CBAHR
SCHEMBL27330315 0.90 ALOX5 (0.39) ALOX5PRKDCPIK3CDPIK3CBAHR
SCHEMBL22523349 0.89 ALOX5 (0.45) ALOX5PRKDCPIK3CDPIK3CBAHR
SCHEMBL27322433 0.89 ALOX5 (0.38) ALOX5PRKDCPIK3CDPIK3CBCDC14B

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
WO-2023199832-A1 COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE 出光興産株式会社 2023-10-19 WO disclosed