SCHEMBL25823521

SCHEMBL25823521

c1ccc2c(c1)-c1cccc3c(-c4ccc(-c5ccc(-c6nc(-c7cccc8oc9ccccc9c78)nc(-c7cccc8oc9ccccc9c78)n6)cc5)cc4)ccc-2c13

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 1/20 0.36
CRHBP P24387 1/20 0.35
CRHR2 Q13324 1/20 0.35
KEAP1 Q14145 1/20 0.35
NFE2L2 Q16236 1/20 0.35
ALDH1A1 P00352 5/20 0.34
HPGD P15428 4/20 0.34
HSD17B10 Q99714 4/20 0.34
TSHR P16473 2/20 0.34
MAPK1 P28482 2/20 0.34
L3MBTL1 Q9Y468 2/20 0.34
CASP1 P29466 2/20 0.34
HIF1A Q16665 1/20 0.34
MAPT P10636 4/20 0.33
ENPP3 O14638 1/20 0.33
ENPP1 P22413 1/20 0.33
ALOX5 P09917 1/20 0.33
KDM4E B2RXH2 4/20 0.32
POLB P06746 1/20 0.32
SMN1; SMN2 Q16637 2/20 0.32

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
SCHEMBL24930302 0.97 MAPT (0.36) BACE1CRHBPCRHR2KEAP1NFE2L2
SCHEMBL24930305 0.96 MAPT (0.37) BACE1CRHBPCRHR2KEAP1NFE2L2
SCHEMBL25844246 0.94 PLA2G2A (0.38) BACE1ALDH1A1HPGDHSD17B10TSHR
SCHEMBL24930837 0.93 MAPT (0.37) BACE1CRHBPCRHR2KEAP1NFE2L2
SCHEMBL24930289 0.92 PLA2G2A (0.36) BACE1ALDH1A1HPGDHSD17B10TSHR
SCHEMBL19271503 0.92 BACE1 (0.37) BACE1CRHBPCRHR2KEAP1NFE2L2
SCHEMBL24930440 0.92 MAPT (0.36) BACE1CRHBPCRHR2KEAP1NFE2L2
SCHEMBL24930445 0.92 MAPT (0.36) BACE1CRHBPCRHR2KEAP1NFE2L2
SCHEMBL24930298 0.91 ALDH1A1 (0.36) BACE1ALDH1A1HPGDHSD17B10TSHR
SCHEMBL24990463 0.91 BACE1 (0.38) BACE1CRHBPCRHR2KEAP1NFE2L2

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-2023125801-A1 FLUORANTHENE DERIVATIVE, LIGHT-EMITTING ELEMENT, AND PHOTOELECTRIC CONVERSION ELEMENT 东丽先端材料研究开发(中国)有限公司 2023-07-06 WO disclosed