SCHEMBL3358454

SCHEMBL3358454

CCN1C(=O)CS/C1=C(/C#N)C(=O)NCC(F)(F)C(F)(F)F

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.44
▸ MAPT P10636 3/20 0.44
▸ MEN1 O00255 3/20 0.44
▸ KMT2A Q03164 3/20 0.44
▸ LMNA P02545 1/20 0.44
▸ ATM Q13315 1/20 0.44
▸ HSD17B10 Q99714 3/20 0.42
▸ DHODH Q02127 8/20 0.39
▸ PLK1 P53350 1/20 0.33
▸ HTT P42858 1/20 0.32
▸ L3MBTL1 Q9Y468 1/20 0.31
▸ USP2 O75604 1/20 0.30
▸ POLB P06746 1/20 0.30
▸ THRB P10828 1/20 0.30
▸ MAPK1 P28482 1/20 0.30
▸ RECQL P46063 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
SCHEMBL13488665 0.91 MEN1 (0.46) ALDH1A1MAPTMEN1KMT2ALMNA
SCHEMBL3354225 0.91 MEN1 (0.46) ALDH1A1MAPTMEN1KMT2ALMNA
SCHEMBL13488664 0.84 ALDH1A1 (0.49) ALDH1A1MAPTMEN1KMT2ALMNA
SCHEMBL3358918 0.84 ALDH1A1 (0.49) ALDH1A1MAPTMEN1KMT2ALMNA
SCHEMBL3358942 0.83 ALDH1A1 (0.48) ALDH1A1MAPTMEN1KMT2ALMNA
SCHEMBL13488667 0.83 ALDH1A1 (0.48) ALDH1A1MAPTMEN1KMT2ALMNA
SCHEMBL3354063 0.82 ALDH1A1 (0.46) ALDH1A1MAPTMEN1KMT2ALMNA
SCHEMBL13537426 0.82 MEN1 (0.34) ALDH1A1MAPTMEN1KMT2AATM
SCHEMBL3358375 0.81 ALDH1A1 (0.46) ALDH1A1MAPTMEN1KMT2ALMNA
SCHEMBL13488666 0.81 ALDH1A1 (0.47) ALDH1A1MAPTMEN1KMT2ALMNA

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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