SCHEMBL4058932

SCHEMBL4058932

C[C@H]1CN([C@@H](c2cc(F)c(F)c(F)c2)[C@@H](C(C)(C)C)C(O[SiH3])(c2ccccc2)c2ccccc2)C(=O)C(=O)O1

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
KEAP1 Q14145 1/20 0.32
NFE2L2 Q16236 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
SCHEMBL4058931 1.00 KEAP1 (0.32) KEAP1NFE2L2
SCHEMBL4057764 0.85
SCHEMBL4057760 0.85
SCHEMBL3626375 0.75 KEAP1 (0.31) KEAP1NFE2L2
SCHEMBL4089186 0.60 SMYD2 (0.31)
SCHEMBL3621048 0.60 SMYD2 (0.31)
SCHEMBL3621050 0.60 SMYD2 (0.31)
SCHEMBL4330555 0.60 HSD11B1 (0.45)
SCHEMBL4330209 0.57 GRM2 (0.48)
SCHEMBL4330213 0.57 GRM2 (0.48)

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
EP-2048143-A1 PRODRUG OF CINNAMIDE COMPOUND Eisai R&D Management Co., Ltd. (JP) 2009-04-15 EP disclosed