SCHEMBL24920776

SCHEMBL24920776

COc1ncc(F)c(-c2noc(C)n2)n1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.36
MAPT P10636 3/20 0.35
HSD17B10 Q99714 3/20 0.35
KDM4E B2RXH2 2/20 0.35
GAA P10253 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
HDAC1 Q13547 1/20 0.35
HDAC6 Q9UBN7 1/20 0.35
HDAC5 Q9UQL6 1/20 0.35
ALDH1A1 P00352 2/20 0.35
HPGD P15428 2/20 0.35
NPC1 O15118 1/20 0.35
TSHR P16473 1/20 0.35
RAB9A P51151 1/20 0.35
AOC3 Q16853 2/20 0.34
LMNA P02545 1/20 0.34
ATM Q13315 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
BDKRB1 P46663 4/20 0.34
CHEK1 O14757 1/20 0.33

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
SCHEMBL24920818 0.77 CYP1A2 (0.33) HSD17B10HDAC1HDAC6HDAC5ALDH1A1
SCHEMBL24920831 0.76 LRRK2 (0.36) HDAC1HDAC6HDAC5AOC3LMNA
SCHEMBL24921566 0.76 MAPT (0.40) L3MBTL1MAPTHSD17B10KDM4EGAA
SCHEMBL24921484 0.76 L3MBTL1 (0.49) L3MBTL1MAPTHSD17B10KDM4EGAA
SCHEMBL24920841 0.74 MAPT (0.42) L3MBTL1MAPTHSD17B10KDM4EGAA
SCHEMBL24920807 0.73 LRRK2 (0.36) HSD17B10ALDH1A1NPC1RAB9AAOC3
SCHEMBL24921982 0.72 MAPT (0.40) L3MBTL1MAPTHSD17B10KDM4EGAA
SCHEMBL24921462 0.71 L3MBTL1 (0.40) L3MBTL1MAPTHSD17B10KDM4EGAA
SCHEMBL24920816 0.71 PDE10A (0.31) HSD17B10ALDH1A1
SCHEMBL24920896 0.71 CYP1A2 (0.31) HSD17B10ALDH1A1

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-2023006097-A1 BIFUNCTIONAL CHIMERIC HETEROCYCLIC COMPOUND AND USE THEREOF AS ANDROGEN RECEPTOR DEGRADER 海创药业股份有限公司 2023-02-02 WO disclosed