SCHEMBL9615252

SCHEMBL9615252

C#CC(I)OC(=O)/C=C\C(=O)OC(I)C#C

nearest known ligand 0.37

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 2/20 0.37
KEAP1 Q14145 1/20 0.31
NFE2L2 Q16236 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
SCHEMBL9615254 0.92 HCAR2 (0.50) HCAR2
SCHEMBL9224105 0.80
SCHEMBL9224114 0.80
SCHEMBL7629357 0.77
SCHEMBL5865960 0.75
SCHEMBL9353261 0.73
SCHEMBL943375 0.73
SCHEMBL9621020 0.71 CYP2D6 (0.31)
SCHEMBL9353321 0.70
SCHEMBL9479660 0.68

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
JP-4128202-A None JP disclosed
JP-H04128202-A ACTIVATOR FOR CUT FLOWER NIPPON IYAKUHIN KAIHATSU KENKYUSHO:KK 1992-04-28 JP disclosed