SCHEMBL7101590

SCHEMBL7101590

CN(C)C(C)(C)OC(=O)c1csc2c1c(=O)n(Cc1ccccc1)c(=O)n2C

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.43
MEN1 O00255 5/20 0.43
ERCC5 P28715 1/20 0.41
FEN1 P39748 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.39
ALDH1A1 P00352 2/20 0.39
LMNA P02545 2/20 0.39
PKM P14618 2/20 0.39
RAB9A P51151 1/20 0.39
TP53 P04637 1/20 0.37
PRNP P04156 1/20 0.37
HTT P42858 1/20 0.37
POLB P06746 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
SCHEMBL6471284 0.83 MEN1 (0.46) KMT2AMEN1ERCC5FEN1SMN1; SMN2
SCHEMBL6472164 0.82 ERCC5 (0.43) KMT2AMEN1ERCC5FEN1SMN1; SMN2
SCHEMBL6465432 0.82 ERCC5 (0.39) KMT2AMEN1ERCC5FEN1SMN1; SMN2
SCHEMBL6255377 0.82 MEN1 (0.52) KMT2AMEN1ERCC5FEN1SMN1; SMN2
SCHEMBL6474542 0.81 ADORA2B (0.44) KMT2AMEN1ERCC5FEN1SMN1; SMN2
SCHEMBL6259891 0.81 MEN1 (0.44) KMT2AMEN1ERCC5FEN1SMN1; SMN2
SCHEMBL6465721 0.80 ERCC5 (0.41) KMT2AMEN1ERCC5FEN1SMN1; SMN2
SCHEMBL6476633 0.80 ALDH1A1 (0.43) KMT2AMEN1ERCC5FEN1SMN1; SMN2
SCHEMBL6470623 0.79 ADORA2B (0.42) KMT2AMEN1ERCC5FEN1SMN1; SMN2
SCHEMBL6730268 0.79 KMT2A (0.42) KMT2AMEN1SMN1; SMN2ALDH1A1LMNA

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-1370562-A1 THIENO[2,3-D]PYRIMIDINDIONE DERIVATIVES AS MATRIX METALLOPROTEINASE INHIBITORS Warner-Lambert Company LLC (US) 2003-12-17 EP disclosed
WO-2002064598-A1 THIENO'2,3-D PYRIMIDINDIONE DERIVATIVES AS MATRIX METALLOPROTEINASE INHIBITORS WARNER-LAMBERT COMPANY LLC (US) 2002-08-22 WO disclosed