SCHEMBL28677646

SCHEMBL28677646

C=C(C)C(=O)ON(CC)C(=O)NCCS(=O)(=O)O

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 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
SCHEMBL28985865 0.92 EPHX2 (0.35) ALDH1A1
SCHEMBL28985846 0.79 ALDH1A1 (0.33) ALDH1A1
SCHEMBL28687581 0.77 ADRA1A (0.39)
SCHEMBL28698296 0.76 EGLN1 (0.39) ALDH1A1
SCHEMBL28612629 0.75 LPAR1 (0.36) ALDH1A1
SCHEMBL28985883 0.74 ALDH1A1 (0.33) ALDH1A1
SCHEMBL2480449 0.69 ALDH1A1 (0.39) ALDH1A1
SCHEMBL41304 0.69 TGFBR1 (0.37) ALDH1A1
SCHEMBL293594 0.69 ALDH1A1 (0.39) ALDH1A1
SCHEMBL2946748 0.69 ALDH1A1 (0.39) ALDH1A1

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-109689189-B Functionalized copolymers and uses thereof 3M创新有限公司 2022-02-01 CN disclosed