SCHEMBL30845063

SCHEMBL30845063

CNC(=O)c1csc2c(C)cc(N3CCN(CC(=O)NC(C)C)CC3)nc12

nearest known ligand 0.77

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ UGT8 Q16880 19/20 0.77
▸ KDM4E B2RXH2 1/20 0.42
▸ ALDH1A1 P00352 1/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.42
▸ TDP1 Q9NUW8 1/20 0.42

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
SCHEMBL21814002 1.00 UGT8 (0.77) UGT8KDM4EALDH1A1SMN1; SMN2TDP1
SCHEMBL21813342 0.90 UGT8 (0.76) UGT8KDM4EALDH1A1SMN1; SMN2TDP1
SCHEMBL21814038 0.90 UGT8 (0.76) UGT8KDM4EALDH1A1SMN1; SMN2TDP1
SCHEMBL21813441 0.88 UGT8 (0.74) UGT8KDM4EALDH1A1SMN1; SMN2TDP1
SCHEMBL21813732 0.88 UGT8 (0.77) UGT8KDM4EALDH1A1SMN1; SMN2TDP1
SCHEMBL21814130 0.88 UGT8 (0.74) UGT8KDM4EALDH1A1SMN1; SMN2TDP1
SCHEMBL21813969 0.87 UGT8 (0.73) UGT8
SCHEMBL21814139 0.87 UGT8 (1.00) UGT8
SCHEMBL30844976 0.87 UGT8 (1.00) UGT8
SCHEMBL21813359 0.87 UGT8 (0.74) UGT8KDM4EALDH1A1SMN1; SMN2TDP1

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
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