SCHEMBL24920841

SCHEMBL24920841

COc1nc(-c2noc(C)n2)ncc1F

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.42
HSD17B10 Q99714 4/20 0.42
KDM4E B2RXH2 3/20 0.42
GAA P10253 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
ALDH1A1 P00352 3/20 0.41
HPGD P15428 3/20 0.41
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
TSHR P16473 1/20 0.41
GUCY1B2 O75343 1/20 0.37
GUCY1A2 P33402 1/20 0.37
GUCY1A1 Q02108 1/20 0.37
GUCY1B1 Q02153 1/20 0.37
LMNA P02545 1/20 0.37
ATM Q13315 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
USP2 O75604 1/20 0.34
TP53 P04637 1/20 0.34

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
SCHEMBL24920806 0.77 GUCY1B2 (0.36) MAPTHSD17B10KDM4ENPSR1ALDH1A1
SCHEMBL24920793 0.76 GUCY1B2 (0.40) GUCY1B2GUCY1A2GUCY1A1GUCY1B1L3MBTL1
SCHEMBL24922534 0.76 PIK3CA (0.47) MAPTHSD17B10KDM4EGAANPSR1
SCHEMBL24921481 0.75 MAPT (0.46) MAPTHSD17B10KDM4EGAANPSR1
SCHEMBL24920782 0.74 PIM1 (0.36) NPC1RAB9AGUCY1B2GUCY1A2GUCY1A1
SCHEMBL24920776 0.74 L3MBTL1 (0.36) MAPTHSD17B10KDM4EGAANPSR1
SCHEMBL24920791 0.72 GUCY1B2 (0.35) HSD17B10KDM4EALDH1A1HPGDNPC1
SCHEMBL24920882 0.72 GUCY1B2 (0.42) HSD17B10KDM4EALDH1A1HPGDNPC1
SCHEMBL16583245 0.71 MAPT (0.47) MAPTHSD17B10KDM4EGAANPSR1
SCHEMBL24921483 0.71 L3MBTL1 (0.39) MAPTHSD17B10KDM4EGAANPSR1

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