SCHEMBL28879453

SCHEMBL28879453

O=C1CCC(=O)N1S(=O)(=O)OS(=O)(=O)O

nearest known ligand 0.36

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PARL Q9H300 4/20 0.36

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
Propionic Acid SCHEMBL28512854 0.86 FFAR3 (0.33) PARL
SCHEMBL3114753 0.76 PARL (0.39) PARL
SCHEMBL4208981 0.74 PARL (0.38) PARL
SCHEMBL28950377 0.74 PARL (0.31) PARL
SCHEMBL28576914 0.73 PARL (0.36) PARL
SCHEMBL36368 0.72 PARL (0.43) PARL
SCHEMBL7736371 0.70 PARL (0.41) PARL
SCHEMBL5086273 0.70 PARL (0.41) PARL
SCHEMBL29748565 0.70 PARL (0.46) PARL
SCHEMBL4226221 0.70 PARL (0.41) PARL

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-115124573-A Novel cytotoxic molecules for use in cell binding molecule-drug conjugates 杭州多禧生物科技有限公司 2022-09-30 CN disclosed