SCHEMBL31335585

SCHEMBL31335585

Cc1c(Cl)c(O)cc(O)c1C(=O)N1Cc2cccc(N(C)C(=O)/C=C/CN(C)C)c2C1

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SPR P35270 2/20 0.36
BTK Q06187 8/20 0.35
LYN P07948 7/20 0.35
TRAP1 Q12931 8/20 0.35
HSP90AA1 P07900 2/20 0.32
HSP90AB1 P08238 1/20 0.32
HSP90B1 P14625 3/20 0.32

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
SCHEMBL31335536 0.93 SPR (0.35) SPRBTKLYNTRAP1HSP90AA1
SCHEMBL31335822 0.92 TRAP1 (0.36) SPRBTKLYNTRAP1HSP90AA1
SCHEMBL31335522 0.91 TRAP1 (0.38) SPRBTKLYNTRAP1HSP90B1
SCHEMBL31335543 0.91 SPR (0.35) SPRBTKLYNTRAP1HSP90AA1
SCHEMBL31335537 0.90 SPR (0.36) SPRBTKLYNTRAP1HSP90AA1
SCHEMBL31335713 0.89 TRAP1 (0.37) SPRBTKLYNTRAP1HSP90B1
SCHEMBL31335760 0.88 TRAP1 (0.33) SPRBTKLYNTRAP1HSP90B1
SCHEMBL31335741 0.87 TRAP1 (0.39) BTKLYNTRAP1HSP90AA1HSP90AB1
SCHEMBL31335646 0.87 SPR (0.43) SPRBTKLYNTRAP1HSP90AA1
SCHEMBL31335618 0.86 SPR (0.39) SPRBTKTRAP1HSP90AA1HSP90AB1

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 4 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 claimed
WO-2024246496-A1 (HETERO)ARYL-CARBONYL-HETEROBICYCLIC COMPOUNDS AS INHIBITORS OF PMS2 FOR CANCER AND DEGENERATIVE ILLNESSES Neophore Limited (GB) 2024-12-05 WO claimed
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