SCHEMBL8686391

SCHEMBL8686391

O=C1NC(=Cc2cn(CC(=O)c3ccccc3)c3ccccc23)C(=O)S1

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 10/20 0.51
MEN1 O00255 7/20 0.50
MAPT P10636 2/20 0.48
POLB P06746 2/20 0.48
GAA P10253 1/20 0.48
ALDH1A1 P00352 1/20 0.47
LMNA P02545 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
PARP1 P09874 8/20 0.46
CRHBP P24387 1/20 0.43
CRHR2 Q13324 1/20 0.43

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
SCHEMBL8685888 0.87 KMT2A (0.40) KMT2AMEN1MAPTPOLBGAA
SCHEMBL8686383 0.87 PARP1 (0.61) KMT2AMEN1MAPTALDH1A1LMNA
SCHEMBL8686384 0.87 PARP1 (0.61) KMT2AMEN1MAPTALDH1A1LMNA
SCHEMBL8686377 0.82 PARP1 (0.50) KMT2AMEN1MAPTPOLBGAA
SCHEMBL8685538 0.82 PARP1 (0.63) KMT2AMEN1MAPTPOLBALDH1A1
SCHEMBL8809303 0.77 PARP1 (0.48) KMT2AMEN1MAPTPOLBGAA
SCHEMBL8810770 0.77 MEN1 (0.51) KMT2AMEN1MAPTPOLBGAA
SCHEMBL8812780 0.77 PARP1 (0.62) KMT2AMEN1MAPTPOLBGAA
SCHEMBL12892091 0.76 KMT2A (0.66) KMT2AMEN1MAPTPOLBALDH1A1
SCHEMBL1249238 0.76 KMT2A (0.66) KMT2AMEN1MAPTPOLBALDH1A1

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
US-5811439-A ANTIDIABETIC AGENTS; SIDE EFFECT REDUCTION; ANTILEPEMIC AGENTS SENGA PHARMACEUTICAL LABORATORY INC. (JP) 1998-09-22 US disclosed
EP-0780389-A1 Thiazolidinedione derivatives, process for their preparation and pharmaceutical compositions containing them TOBISHI PHARMACEUTICAL CO., LTD. (JP) 1997-06-25 EP disclosed