SCHEMBL29057487

SCHEMBL29057487

C=CC(=O)Nc1ncc(CN2CCN(CC(=O)Oc3ccc(OC)cc3)CC2)s1

nearest known ligand 0.61

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
OGA O60502 18/20 0.61
SMN1; SMN2 Q16637 2/20 0.49
KMT2A Q03164 1/20 0.47
HTT P42858 1/20 0.45

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
SCHEMBL29057503 0.91 OGA (0.56) OGASMN1; SMN2HTT
SCHEMBL29057434 0.88 OGA (0.77) OGA
SCHEMBL29057500 0.87 OGA (0.49) OGASMN1; SMN2HTT
SCHEMBL29057514 0.82 SMN1; SMN2 (0.47) OGASMN1; SMN2
SCHEMBL29057483 0.80 OGA (0.62) OGA
SCHEMBL29057513 0.80 OGA (0.47) OGASMN1; SMN2HTT
SCHEMBL29057456 0.80 OGA (0.72) OGA
SCHEMBL29057459 0.80 OGA (0.72) OGA
SCHEMBL27008594 0.79 OGA (0.71) OGA
SCHEMBL29057526 0.79 OGA (0.65) OGA

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-116438167-A Compounds having O-GlcNAc enzyme inhibitory activity and uses thereof 美迪福伦DBT有限公司 2023-07-14 CN disclosed