SCHEMBL26568543

SCHEMBL26568543

c1ccc(-c2ccc(N(c3ccccc3-c3ccc4c(c3)oc3ccccc34)c3ccccc3-c3cccc4cccc(-c5ccccc5)c34)cc2)cc1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.34
HCRTR1 O43613 1/20 0.34
MMP12 P39900 1/20 0.33
MMP13 P45452 1/20 0.33
PRKDC P78527 1/20 0.33
AHR P35869 2/20 0.33
ALDH1A1 P00352 3/20 0.32
KDM4E B2RXH2 2/20 0.32
HPGD P15428 2/20 0.32
MEN1 O00255 2/20 0.32
MAPT P10636 2/20 0.32
KMT2A Q03164 2/20 0.32
DUSP3 P51452 1/20 0.31
HSD17B1 P14061 1/20 0.31
HSD17B2 P37059 1/20 0.31
RAB9A P51151 2/20 0.31
MAOB P27338 1/20 0.31
TP53 P04637 1/20 0.31
TSHR P16473 1/20 0.31
MAPK1 P28482 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
SCHEMBL26585162 0.99 HCRTR1 (0.35) ALOX5HCRTR1MMP12MMP13PRKDC
SCHEMBL26569449 0.98 HCRTR1 (0.36) ALOX5HCRTR1MMP12MMP13PRKDC
SCHEMBL26569293 0.98 HCRTR1 (0.36) ALOX5HCRTR1MMP12MMP13PRKDC
SCHEMBL26585161 0.97 ALOX5 (0.34) ALOX5HCRTR1MMP12MMP13PRKDC
SCHEMBL26569835 0.97 ALOX5 (0.35) ALOX5HCRTR1MMP12MMP13PRKDC
SCHEMBL26584467 0.96 PLA2G2A (0.34) ALOX5HCRTR1MMP12MMP13PRKDC
SCHEMBL26588448 0.95 HCRTR1 (0.35) ALOX5HCRTR1MMP12MMP13PRKDC
SCHEMBL26585271 0.94 HCRTR1 (0.37) ALOX5HCRTR1MMP12MMP13PRKDC
SCHEMBL26569349 0.94 AHR (0.33) ALOX5HCRTR1MMP12MMP13AHR
SCHEMBL26568451 0.94 HCRTR1 (0.37) ALOX5HCRTR1MMP12MMP13PRKDC

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-2023182323-A1 COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE 出光興産株式会社 2023-09-28 WO disclosed