SCHEMBL31335899

SCHEMBL31335899

C=CC(=O)N(C)c1cccc2c1CN(C(=O)c1c(OC(C)=O)cc(OC(C)=O)c(C)c1C)C2

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
BTK Q06187 6/20 0.33
TRAP1 Q12931 4/20 0.32
HSP90B1 P14625 2/20 0.32
SLC6A9 P48067 1/20 0.32
KRAS P01116 6/20 0.32
FGFR4 P22455 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
ACHE P22303 1/20 0.30

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
SCHEMBL31335781 0.82 TRAP1 (0.39) BTKTRAP1HSP90B1
SCHEMBL25216773 0.80 TRAP1 (0.38) TRAP1HSP90B1KRAS
SCHEMBL30970481 0.80 TRAP1 (0.38) TRAP1HSP90B1KRAS
SCHEMBL31335751 0.78 TRAP1 (0.40) TRAP1HSP90B1KRASFGFR4
SCHEMBL31336035 0.77 TRAP1 (0.36) TRAP1HSP90B1SLC6A9TDP1L3MBTL1
SCHEMBL31335618 0.77 SPR (0.39) BTKTRAP1HSP90B1KRAS
SCHEMBL31335962 0.77 TRAP1 (0.41) TRAP1HSP90B1TDP1ACHE
SCHEMBL31335926 0.75 TRAP1 (0.37) TRAP1HSP90B1SLC6A9TDP1L3MBTL1
SCHEMBL31335875 0.74 TRAP1 (0.34) TRAP1HSP90B1SLC6A9TDP1L3MBTL1
SCHEMBL31335788 0.74 TRAP1 (0.48) TRAP1HSP90B1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4720038-A1 (HETERO)ARYL-CARBONYL-HETEROBICYCLIC COMPOUNDS AS INHIBITORS OF PMS2 FOR CANCER AND DEGENERATIVE ILLNESSES Neophore Limited (GB) 2026-04-08 EP disclosed
WO-2024246496-A1 (HETERO)ARYL-CARBONYL-HETEROBICYCLIC COMPOUNDS AS INHIBITORS OF PMS2 FOR CANCER AND DEGENERATIVE ILLNESSES Neophore Limited (GB) 2024-12-05 WO disclosed