SCHEMBL29230925

SCHEMBL29230925

O=C(NC(c1ccccc1)c1ccc(C2CC(F)(F)C2)c(F)n1)C1CC(F)CN1C(=O)Cc1nc(C(F)(F)F)co1

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ CFD P00746 13/20 0.33
▸ PSMB9 P28065 1/20 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
SCHEMBL24665924 1.00 CFD (0.33) CFDPSMB9
SCHEMBL30341249 1.00 CFD (0.33) CFDPSMB9
SCHEMBL29820421 1.00 CFD (0.33) CFDPSMB9
SCHEMBL29230954 0.93 CFD (0.34) CFDPSMB9
SCHEMBL30341259 0.93 CFD (0.34) CFDPSMB9
SCHEMBL29820322 0.93 CFD (0.34) CFDPSMB9
SCHEMBL26816644 0.93 CFD (0.34) CFDPSMB9
SCHEMBL29820193 0.92 CFD (0.37) CFDPSMB9
SCHEMBL30341188 0.92 CFD (0.37) CFDPSMB9
SCHEMBL24666875 0.92 CFD (0.37) CFDPSMB9

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
CN-117956985-A Inhibitors of glycogen synthase 1 (GYS 1) and methods of use thereof 梅兹治疗公司 2024-04-30 — — CN disclosed
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