SCHEMBL22481780

SCHEMBL22481780

CCc1ncc(NS(C)(=O)=O)s1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA1 P00915 1/20 0.38
▸ CA2 P00918 1/20 0.38
▸ CA4 P22748 1/20 0.38
▸ CA5A P35218 1/20 0.38
▸ CA5B Q9Y2D0 1/20 0.38
▸ HSD17B10 Q99714 3/20 0.37
▸ ALDH1A1 P00352 2/20 0.36
▸ ATM Q13315 1/20 0.36
▸ LMNA P02545 1/20 0.36
▸ LOXL2 Q9Y4K0 6/20 0.35
▸ MAPT P10636 3/20 0.35
▸ SMN1; SMN2 Q16637 2/20 0.35
▸ HPGD P15428 1/20 0.35
▸ L3MBTL1 Q9Y468 1/20 0.35
▸ TLR8 Q9NR97 1/20 0.35
▸ AKT1 P31749 1/20 0.34
▸ PTGS1 P23219 2/20 0.33
▸ PTGS2 P35354 1/20 0.33
▸ TP53 P04637 1/20 0.33
▸ LOX P28300 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
SCHEMBL14415019 0.76 HCAR2 (0.38) HSD17B10ALDH1A1LMNAHPGDPTGS1
SCHEMBL25978773 0.75 — —
Hydrochloric Acid SCHEMBL28350625 0.73 NPC1 (0.32) LMNALOXL2
SCHEMBL14038178 0.73 NPC1 (0.32) ALDH1A1HPGD
SCHEMBL28165007 0.73 TLR8 (0.31) ALDH1A1MAPTTLR8
SCHEMBL22020738 0.72 LOXL2 (0.49) LOXL2LOX
SCHEMBL21899251 0.71 L3MBTL1 (0.36) HSD17B10ALDH1A1LMNASMN1; SMN2L3MBTL1
SCHEMBL15357789 0.70 FDPS (0.32) —
SCHEMBL14419839 0.68 ALDH1A1 (0.32) ALDH1A1LMNAMAPTTDP1
SCHEMBL21963284 0.67 LOXL2 (0.51) LOXL2LOX

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-2020198711-A1 ANDROGEN RECEPTOR MODULATORS AND METHODS FOR USE AS PROTEOLYSIS TARGETING CHIMERA LIGANDS ESSA PHARMA, INC. (CA) 2020-10-01 — — WO disclosed
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