SCHEMBL21828476

SCHEMBL21828476

CNC(=O)c1csc2c(OCC(F)(F)F)cc(N3CC[CH]CC3)nc12

nearest known ligand 0.56

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ UGT8 Q16880 19/20 0.56
▸ ALDH1A1 P00352 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
SCHEMBL21813839 0.84 UGT8 (0.71) UGT8
SCHEMBL21814022 0.84 UGT8 (0.78) UGT8
SCHEMBL21813890 0.82 UGT8 (0.78) UGT8
SCHEMBL21813463 0.80 UGT8 (0.52) UGT8
SCHEMBL21813440 0.79 UGT8 (0.61) UGT8
SCHEMBL21813540 0.79 UGT8 (0.51) UGT8
SCHEMBL21813998 0.79 UGT8 (0.66) UGT8
SCHEMBL21813379 0.78 UGT8 (0.51) UGT8
SCHEMBL21813378 0.77 UGT8 (0.49) UGT8
SCHEMBL21814211 0.77 UGT8 (0.52) 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
EP-3861000-A1 THIENO[3,2-B]PYRIDINE DERIVATIVES AS UDP GLYCOSYLTRANSFERASE INHIBITORS AND METHODS OF USE Genzyme Corporation (US) 2021-08-11 — — EP disclosed
WO-2020072504-A1 THIENO[3,2-B]PYRIDINE DERIVATIVES AS UDP GLYCOSYLTRANSFERASE INHIBITORS AND METHODS OF USE GENZYME CORPORATION (US) 2020-04-09 — — WO disclosed
Send feedback