SCHEMBL13537424

SCHEMBL13537424

CCN1C(=O)CS/C1=C(/N)C(=O)NC(C)(C)CO

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ MAPT P10636 1/20 0.36
▸ HSD17B10 Q99714 1/20 0.36
▸ ALDH1A1 P00352 4/20 0.33
▸ ATM Q13315 1/20 0.33
▸ HTT P42858 1/20 0.33
▸ L3MBTL1 Q9Y468 2/20 0.32
▸ USP2 O75604 1/20 0.31
▸ TSHR P16473 1/20 0.31
▸ NPSR1 Q6W5P4 1/20 0.31
▸ GFER P55789 1/20 0.30
▸ GSK3A P49840 1/20 0.30
▸ GSK3B P49841 1/20 0.30

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
SCHEMBL3351301 0.81 MEN1 (0.43) MEN1KMT2AMAPTHSD17B10ALDH1A1
SCHEMBL13488670 0.81 MEN1 (0.43) MEN1KMT2AMAPTHSD17B10ALDH1A1
SCHEMBL13537262 0.80 MEN1 (0.39) MEN1KMT2AMAPTHSD17B10ALDH1A1
SCHEMBL13537540 0.77 KMT2A (0.43) MEN1KMT2AMAPTHSD17B10ALDH1A1
SCHEMBL13537259 0.77 MEN1 (0.38) MEN1KMT2AMAPTHSD17B10ALDH1A1
SCHEMBL13537354 0.75 MAPT (0.34) MEN1KMT2AMAPTHSD17B10ALDH1A1
SCHEMBL14622086 0.72 MEN1 (0.35) MEN1KMT2AMAPTHSD17B10ALDH1A1
SCHEMBL27608571 0.69 MAPT (0.48) MEN1KMT2AMAPTHSD17B10ALDH1A1
SCHEMBL14608231 0.66 HTT (0.44) MEN1KMT2AMAPTHSD17B10ALDH1A1
SCHEMBL3358918 0.63 ALDH1A1 (0.49) MEN1KMT2AMAPTHSD17B10ALDH1A1

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
EP-2141163-A1 Substituted thiazolidinones, their production and utilisation as medicine Bayer Schering Pharma AG (DE) 2010-01-06 — — EP disclosed
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