SCHEMBL8526757

SCHEMBL8526757

CCN1CCC(=O)N(c2c(C)cccc2Cl)C1=S

nearest known ligand 0.50

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 8/20 0.50
KMT2A Q03164 8/20 0.50
GAA P10253 1/20 0.44
P2RX7 Q99572 6/20 0.39
L3MBTL1 Q9Y468 1/20 0.36
POLB P06746 1/20 0.36
ALDH1A1 P00352 1/20 0.34

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
SCHEMBL8527236 0.91 MEN1 (0.56) MEN1KMT2AGAAL3MBTL1POLB
SCHEMBL8665062 0.87 MEN1 (0.62) MEN1KMT2AGAAP2RX7
SCHEMBL8584049 0.86 KMT2A (0.61) MEN1KMT2AGAAP2RX7POLB
SCHEMBL9013933 0.78 KMT2A (0.53) MEN1KMT2AGAAP2RX7L3MBTL1
SCHEMBL8684762 0.78 MEN1 (0.51) MEN1KMT2AGAAP2RX7L3MBTL1
SCHEMBL8714673 0.78 MEN1 (0.57) MEN1KMT2AGAAP2RX7ALDH1A1
SCHEMBL8479289 0.76 KMT2A (0.70) MEN1KMT2AGAAL3MBTL1POLB
SCHEMBL8526296 0.75 MEN1 (0.51) MEN1KMT2AGAAL3MBTL1POLB
SCHEMBL7653392 0.75 P2RX7 (0.39) MEN1KMT2AP2RX7L3MBTL1POLB
SCHEMBL8527399 0.74 KMT2A (0.43) MEN1KMT2AGAAP2RX7POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0885197-A1 2-THIOXOTETRAHYDROPYRIMIDIN-4-ONE DERIVATIVES AMERICAN HOME PRODUCTS CORPORATION (US) 1998-12-23 EP claimed
US-5807864-A INCREASING HIGH DENSITY LIPOPROTEIN LEVELS AMERICAN HOME PRODUCTS CORPORATION (US) 1998-09-15 US claimed
WO-1997032855-A1 2-THIOXOTETRAHYDROPYRIMIDIN-4-ONE DERIVATIVES AMERICAN HOME PRODUCTS CORPORATION (US) 1997-09-12 WO claimed
EP-0885197-A1 2-THIOXOTETRAHYDROPYRIMIDIN-4-ONE DERIVATIVES AMERICAN HOME PRODUCTS CORPORATION (US) 1998-12-23 EP disclosed
US-5807864-A INCREASING HIGH DENSITY LIPOPROTEIN LEVELS AMERICAN HOME PRODUCTS CORPORATION (US) 1998-09-15 US disclosed
WO-1997032855-A1 2-THIOXOTETRAHYDROPYRIMIDIN-4-ONE DERIVATIVES AMERICAN HOME PRODUCTS CORPORATION (US) 1997-09-12 WO disclosed