SCHEMBL28211302

SCHEMBL28211302

NCOC(=O)C(=O)OCN

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GLRA1 P23415 1/20 0.35
SLC6A9 P48067 1/20 0.35
OR51E2 Q9H255 1/20 0.35
ALOX15 P16050 1/20 0.33
CYP1A2 P05177 1/20 0.31
ALDH1A1 P00352 1/20 0.30

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
SCHEMBL28523572 0.81
SCHEMBL1450477 0.77
SCHEMBL1548450 0.76
SCHEMBL182508 0.76 LMNA (0.32) ALOX15ALDH1A1
Hydrochloric Acid SCHEMBL31243725 0.74
SCHEMBL1032564 0.74
SCHEMBL9864363 0.74
SCHEMBL1450480 0.74
SCHEMBL3357134 0.73
SCHEMBL8000717 0.73

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-107814758-A Preparation of pyrrole sulfonic acid compound salt 江苏柯菲平医药股份有限公司 2018-03-20 CN disclosed