SCHEMBL8527236

SCHEMBL8527236

CCN1CCC(=O)N(c2c(C)cccc2C)C1=S

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 6/20 0.56
KMT2A Q03164 6/20 0.56
GAA P10253 3/20 0.51
L3MBTL1 Q9Y468 2/20 0.37
HTR2B P41595 3/20 0.36
OPRM1 P35372 2/20 0.36
POLB P06746 1/20 0.36
ADRA2A P08913 1/20 0.36
DRD4 P21917 1/20 0.36
HRH2 P25021 1/20 0.36
HTR7 P34969 1/20 0.36
OPRK1 P41145 1/20 0.36
SLC6A3 Q01959 1/20 0.36
LMNA P02545 2/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
ALDH1A1 P00352 2/20 0.36
KDM4E B2RXH2 1/20 0.36
NPC1 O15118 1/20 0.36
ALOX15 P16050 1/20 0.36
RAB9A P51151 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
SCHEMBL8584049 0.92 KMT2A (0.61) MEN1KMT2AGAAPOLBLMNA
SCHEMBL8526757 0.91 MEN1 (0.50) MEN1KMT2AGAAL3MBTL1POLB
SCHEMBL8479289 0.85 KMT2A (0.70) MEN1KMT2AGAAL3MBTL1POLB
SCHEMBL8684762 0.83 MEN1 (0.51) MEN1KMT2AGAAL3MBTL1HTR2B
SCHEMBL8526296 0.83 MEN1 (0.51) MEN1KMT2AGAAL3MBTL1HTR2B
SCHEMBL8526206 0.78 MEN1 (0.44) MEN1KMT2AGAALMNADPP4
SCHEMBL8476134 0.77 KMT2A (0.75) MEN1KMT2AGAAL3MBTL1POLB
SCHEMBL8665062 0.76 MEN1 (0.62) MEN1KMT2AGAALMNASMN1; SMN2
SCHEMBL8526950 0.74 KMT2A (0.41) MEN1KMT2AGAAL3MBTL1POLB
SCHEMBL8527399 0.74 KMT2A (0.43) MEN1KMT2AGAAPOLBLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5807864-A INCREASING HIGH DENSITY LIPOPROTEIN LEVELS AMERICAN HOME PRODUCTS CORPORATION (US) 1998-09-15 US 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