SCHEMBL28826412

SCHEMBL28826412

C/C=C(\C)C(=O)ONC(=O)CBr

nearest known ligand 0.35

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 1/20 0.35

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
SCHEMBL6407045 0.78 ALDH1A1 (0.30)
SCHEMBL28128623 0.78 NFKB1 (0.35)
SCHEMBL11360303 0.76 CRBN (0.35)
SCHEMBL28286283 0.72
SCHEMBL15564 0.72 ALDH1A1 (0.40) TRPA1
SCHEMBL2885692 0.70
SCHEMBL14829167 0.70 ALDH1A1 (0.39) TRPA1
SCHEMBL17499009 0.70 GLO1 (0.30)
SCHEMBL3596256 0.70 GLO1 (0.30)
SCHEMBL9300260 0.69 PAOX (0.31)

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-103570630-B Nitrogen heterocyclic derivative and the application in medicine thereof SUNSHINE LAKE PHARMA CO.,LTD. (CN) 2016-04-20 CN disclosed