SCHEMBL9414552

SCHEMBL9414552

O=C(F)Oc1c(F)nc(F)nc1Cl

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
SCHEMBL9414551 0.90 KEAP1 (0.34) KEAP1NFE2L2
SCHEMBL9414604 0.86
SCHEMBL9414543 0.85 KEAP1 (0.32) KEAP1NFE2L2
SCHEMBL9414547 0.78 KEAP1 (0.31) KEAP1NFE2L2
SCHEMBL9414553 0.75 KEAP1 (0.31) KEAP1NFE2L2
SCHEMBL9136650 0.69 KEAP1 (0.31) KEAP1NFE2L2
SCHEMBL7808679 0.68
SCHEMBL9137791 0.66 KEAP1 (0.33) KEAP1NFE2L2
SCHEMBL8581211 0.62
SCHEMBL18697361 0.62 CA1 (0.35)

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-0603595-A1 Fibre reactive dyes, method for their preparation and their use HOECHST AKTIENGESELLSCHAFT (DE) 1994-06-29 EP disclosed