SCHEMBL13897767

SCHEMBL13897767

CCN1C(=O)CSC1=C(C#N)c1cccnc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 7/20 0.50
▸ MEN1 O00255 6/20 0.50
▸ HSD17B10 Q99714 5/20 0.50
▸ MAPT P10636 5/20 0.50
▸ GAA P10253 3/20 0.42
▸ ALDH1A1 P00352 3/20 0.42
▸ RECQL P46063 3/20 0.42
▸ LMNA P02545 2/20 0.42
▸ THRB P10828 2/20 0.42
▸ MAPK1 P28482 2/20 0.42
▸ ALOX15 P16050 2/20 0.42
▸ TP53 P04637 1/20 0.42
▸ HTT P42858 1/20 0.42
▸ TDP1 Q9NUW8 1/20 0.42
▸ CYP1A2 P05177 1/20 0.38
▸ CYP11B1 P15538 1/20 0.38
▸ CYP11B2 P19099 1/20 0.38
▸ POLB P06746 2/20 0.38
▸ KDM4E B2RXH2 1/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.36

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
SCHEMBL13899685 1.00 KMT2A (0.50) KMT2AMEN1HSD17B10MAPTGAA
SCHEMBL13899791 0.85 KMT2A (0.51) KMT2AMEN1HSD17B10MAPTALDH1A1
SCHEMBL13897542 0.85 KMT2A (0.51) KMT2AMEN1HSD17B10MAPTALDH1A1
SCHEMBL6087113 0.85 MEN1 (0.62) KMT2AMEN1HSD17B10MAPTGAA
SCHEMBL6087108 0.85 MEN1 (0.62) KMT2AMEN1HSD17B10MAPTGAA
SCHEMBL13897706 0.78 MEN1 (0.54) KMT2AMEN1HSD17B10MAPTGAA
SCHEMBL13899605 0.78 MEN1 (0.54) KMT2AMEN1HSD17B10MAPTGAA
SCHEMBL13897921 0.77 KMT2A (0.50) KMT2AMEN1HSD17B10MAPTGAA
SCHEMBL13899699 0.77 KMT2A (0.50) KMT2AMEN1HSD17B10MAPTGAA
SCHEMBL13897914 0.75 KMT2A (0.53) KMT2AMEN1HSD17B10MAPTALDH1A1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7511059-B2 Thiazolidinones, their production and use as pharmaceutical agents SCHERING AG (DE) 2009-03-31 — — US disclosed
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