SCHEMBL30844980

SCHEMBL30844980

CNC(=O)c1csc2c(C(F)(F)F)c(C)c(O[C@H]3CCN(C(=O)OC(C)(C)C)C[C@H]3F)nc12

nearest known ligand 0.42

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ UGT8 Q16880 17/20 0.42
▸ EED O75530 2/20 0.40
▸ RBBP4 Q09028 2/20 0.40
▸ SUZ12 Q15022 2/20 0.40
▸ EZH2 Q15910 2/20 0.40
▸ AEBP2 Q6ZN18 2/20 0.40
▸ PIK3CD O00329 1/20 0.37

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
SCHEMBL21862149 1.00 UGT8 (0.42) UGT8EEDRBBP4SUZ12EZH2
SCHEMBL21813545 0.91 EED (0.45) EEDRBBP4SUZ12EZH2AEBP2
SCHEMBL21813548 0.91 EED (0.45) EEDRBBP4SUZ12EZH2AEBP2
SCHEMBL30845409 0.91 EED (0.45) EEDRBBP4SUZ12EZH2AEBP2
SCHEMBL21813815 0.90 UGT8 (0.42) UGT8
SCHEMBL21813813 0.90 UGT8 (0.42) UGT8
SCHEMBL21813767 0.90 UGT8 (0.42) UGT8
SCHEMBL30845110 0.90 UGT8 (0.48) UGT8EEDRBBP4SUZ12EZH2
SCHEMBL21862150 0.88 UGT8 (0.46) UGT8EEDRBBP4SUZ12EZH2
SCHEMBL30845059 0.88 UGT8 (0.46) UGT8EEDRBBP4SUZ12EZH2

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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