SCHEMBL30845124

SCHEMBL30845124

CNC(=O)c1csc2c(C(F)(F)F)cc(N3CC(NC(=O)OC(C)(C)C)C3)nc12

nearest known ligand 0.76

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
UGT8 Q16880 19/20 0.76
KDM4E B2RXH2 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
SCHEMBL21862140 1.00 UGT8 (0.76) UGT8KDM4E
SCHEMBL30845016 0.91 UGT8 (0.78) UGT8KDM4E
SCHEMBL21813689 0.88 UGT8 (0.73) UGT8KDM4E
SCHEMBL21862617 0.85 UGT8 (0.64) UGT8
SCHEMBL30845443 0.85 UGT8 (0.64) UGT8
SCHEMBL21813623 0.84 UGT8 (0.59) UGT8KDM4E
SCHEMBL30845269 0.84 UGT8 (0.57) UGT8
SCHEMBL21814116 0.83 UGT8 (0.58) UGT8KDM4E
SCHEMBL21813945 0.83 UGT8 (0.69) UGT8
SCHEMBL21813598 0.83 UGT8 (0.66) UGT8

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113423711-B Thieno [3,2-B ] pyridine derivatives as UDP glycosyltransferase inhibitors and methods of use thereof 建新公司 2024-03-15 CN claimed
CN-113423711-B Thieno [3,2-B ] pyridine derivatives as UDP glycosyltransferase inhibitors and methods of use thereof 建新公司 2024-03-15 CN disclosed