SCHEMBL28811649

SCHEMBL28811649

O=C=NC(CC(=O)O)C(F)(F)F

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SLC22A6 Q4U2R8 1/20 0.32
TDP1 Q9NUW8 1/20 0.31
SMN1; SMN2 Q16637 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
SCHEMBL11577897 0.70 SLC22A6 (0.39) SLC22A6TDP1SMN1; SMN2
SCHEMBL49404 0.68 SLC22A6 (0.33) SLC22A6TDP1SMN1; SMN2
SCHEMBL8711551 0.67 TDP1 (0.40) SLC22A6TDP1SMN1; SMN2
SCHEMBL2383532 0.67
SCHEMBL9003866 0.67 TDP1 (0.40) SLC22A6TDP1SMN1; SMN2
SCHEMBL2279444 0.67 TDP1 (0.40) SLC22A6TDP1SMN1; SMN2
Water SCHEMBL28069402 0.65 TDP1 (0.39) SLC22A6TDP1SMN1; SMN2
SCHEMBL3067310 0.64 SLC22A6 (0.43) SLC22A6TDP1SMN1; SMN2
SCHEMBL8877183 0.64 SLC22A6 (0.43) SLC22A6TDP1SMN1; SMN2
SCHEMBL1967208 0.62 SLC22A6 (0.48) SLC22A6TDP1SMN1; SMN2

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-114736352-A Imidazoline polymer and preparation method and application thereof 江苏南方包装有限公司 2022-07-12 CN disclosed