SCHEMBL25823866

SCHEMBL25823866

c1ccc(-c2cccc(-c3nc(-c4ccccc4)nc(-c4ccccc4-c4ccc(-c5ccc6c7c(cccc57)-c5ccccc5-6)cc4)n3)c2)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.38
HPGD P15428 4/20 0.38
L3MBTL1 Q9Y468 4/20 0.38
TSHR P16473 3/20 0.38
MAPK1 P28482 2/20 0.38
HSD17B10 Q99714 2/20 0.38
CASP1 P29466 1/20 0.38
HIF1A Q16665 1/20 0.38
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA9 Q16790 1/20 0.38
MEN1 O00255 4/20 0.37
MAPT P10636 4/20 0.37
KMT2A Q03164 4/20 0.37
ATM Q13315 3/20 0.37
LMNA P02545 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
APAF1 O14727 1/20 0.37
NPC1 O15118 1/20 0.37

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
SCHEMBL25823877 1.00 ALDH1A1 (0.38) ALDH1A1HPGDL3MBTL1TSHRMAPK1
SCHEMBL25823880 0.97 ALDH1A1 (0.40) ALDH1A1HPGDL3MBTL1TSHRMAPK1
SCHEMBL25822853 0.96 ALDH1A1 (0.41) ALDH1A1HPGDL3MBTL1TSHRMAPK1
SCHEMBL25823259 0.96 ALDH1A1 (0.41) ALDH1A1HPGDL3MBTL1TSHRMAPK1
SCHEMBL23099294 0.94 ALDH1A1 (0.38) ALDH1A1HPGDL3MBTL1TSHRMAPK1
SCHEMBL25823883 0.94 ALDH1A1 (0.40) ALDH1A1HPGDL3MBTL1TSHRMAPK1
SCHEMBL25823871 0.94 ALDH1A1 (0.40) ALDH1A1HPGDL3MBTL1TSHRMAPK1
SCHEMBL25823621 0.94 TSHR (0.40) ALDH1A1HPGDL3MBTL1TSHRMAPK1
SCHEMBL25823339 0.94 TSHR (0.40) ALDH1A1HPGDL3MBTL1TSHRMAPK1
SCHEMBL25823261 0.94 TSHR (0.40) ALDH1A1HPGDL3MBTL1TSHRMAPK1

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