SCHEMBL29586199

SCHEMBL29586199

CCc1cc(-c2cc(C(=O)N3CCC(C(N)=O)CC34CC4)n[nH]2)c(F)cn1

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ KDM5A P29375 1/20 0.32
▸ PDE4B Q07343 1/20 0.31
▸ TLR9 Q9NR96 1/20 0.31
▸ TLR8 Q9NR97 1/20 0.31
▸ TLR7 Q9NYK1 1/20 0.31

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
SCHEMBL25090954 0.90 TLR8 (0.36) KDM5APDE4BTLR9TLR8TLR7
SCHEMBL29584646 0.90 TLR8 (0.36) KDM5APDE4BTLR9TLR8TLR7
SCHEMBL30298816 0.88 KDM5A (0.31) KDM5APDE4B
SCHEMBL29584301 0.87 FFAR4 (0.37) PDE4BTLR9TLR8TLR7
SCHEMBL25090729 0.87 FFAR4 (0.37) PDE4BTLR9TLR8TLR7
SCHEMBL24424040 0.87 FFAR4 (0.37) PDE4BTLR9TLR8TLR7
SCHEMBL30630568 0.87 FFAR4 (0.37) PDE4BTLR9TLR8TLR7
SCHEMBL24424784 0.83 BACE1 (0.34) KDM5A
SCHEMBL24424783 0.83 BACE1 (0.34) KDM5A
SCHEMBL25090994 0.83 KDM5A (0.32) KDM5A

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-4240736-A1 PPAR GAMMA MODULATORS AND METHODS OF USE Eisai R&D Management Co., Ltd. (JP) 2023-09-13 — — EP disclosed
WO-2022099144-A1 ΡΡΑRγ MODULATORS AND METHODS OF USE Eisai R&D Mangement Co., Ltd. (JP) 2022-05-12 — — WO disclosed
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