SCHEMBL23028846

SCHEMBL23028846

c1ccc(C23c4ccccc4Oc4cc(-c5cccc6sc7ccccc7c56)cc(c42)Oc2ccccc23)cc1

nearest known ligand 0.34

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
BRDT Q58F21 1/20 0.34
LIMK1 P53667 1/20 0.31
GPR3 P46089 1/20 0.31
F9 P00740 1/20 0.30
ALOX5 P09917 1/20 0.30
MEN1 O00255 1/20 0.30
POLB P06746 1/20 0.30
MAPT P10636 1/20 0.30
DUSP3 P51452 1/20 0.30
BLM P54132 1/20 0.30
PTPN5 P54829 1/20 0.30
KMT2A Q03164 1/20 0.30
PTPN11 Q06124 1/20 0.30
MCL1 Q07820 1/20 0.30
CTDSP1 Q9GZU7 1/20 0.30
TDP1 Q9NUW8 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
SCHEMBL17482908 0.86 ALOX5 (0.36) BRDTLIMK1GPR3ALOX5MEN1
SCHEMBL17482882 0.85 LIMK1 (0.34) BRDTLIMK1F9ALOX5
SCHEMBL23028714 0.84
SCHEMBL17482906 0.80 ALOX5 (0.30) ALOX5
SCHEMBL23028845 0.79 GPR84 (0.32)
SCHEMBL22104846 0.79 MEN1 (0.36) BRDTLIMK1GPR3F9ALOX5
SCHEMBL23028859 0.78 ALDH1A1 (0.36) LIMK1GPR3ALOX5POLBMAPT
SCHEMBL17482878 0.77 PDK2 (0.37) LIMK1ALOX5
SCHEMBL17482895 0.77 KDM4E (0.32) BRDT
SCHEMBL17489725 0.77 ALOX5 (0.40) BRDTLIMK1GPR3F9ALOX5

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-2021034089-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC ELEMENT USING SAME, AND ELECTRONIC DEVICE THEREOF 덕산네오룩스 주식회사 2021-02-25 WO disclosed