SCHEMBL4754484

SCHEMBL4754484

O=S(=O)(Cl)N1CCN(c2ccc(Cl)cn2)CC1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 1/20 0.54
CNR2 P34972 1/20 0.54
L3MBTL1 Q9Y468 1/20 0.50
KMT2A Q03164 3/20 0.48
MEN1 O00255 1/20 0.47
DRD2 P14416 4/20 0.46
PANK3 Q9H999 1/20 0.46
KDM4E B2RXH2 1/20 0.46
LMNA P02545 1/20 0.46
HSD17B10 Q99714 1/20 0.46
DRD4 P21917 3/20 0.45
HTR1A P08908 2/20 0.45
HTR2A P28223 2/20 0.45
HTR2C P28335 2/20 0.45
HTR7 P34969 2/20 0.45
DRD3 P35462 2/20 0.45
TMEM97 Q5BJF2 2/20 0.45
SIGMAR1 Q99720 2/20 0.45
ALDH1A1 P00352 1/20 0.43
GAA P10253 1/20 0.43

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
SCHEMBL2155271 0.87 GPR119 (0.59) GPR119CNR2L3MBTL1KMT2APANK3
SCHEMBL4674581 0.81 CNR2 (0.49) GPR119CNR2L3MBTL1KMT2ADRD2
SCHEMBL2959440 0.81 CHRM4 (0.66) GPR119L3MBTL1KMT2AMEN1ALDH1A1
SCHEMBL4958636 0.80 GPR119 (0.46) GPR119CNR2L3MBTL1KMT2ADRD2
SCHEMBL4958144 0.79 GPR119 (0.46) GPR119CNR2L3MBTL1KMT2AMEN1
SCHEMBL4754464 0.78 KDM4E (0.67) GPR119L3MBTL1KMT2AMEN1KDM4E
SCHEMBL16695272 0.78 CNR2 (0.73) GPR119CNR2KMT2ADRD2PANK3
SCHEMBL972745 0.77 CNR2 (0.54) GPR119CNR2KMT2ADRD2PANK3
SCHEMBL6125262 0.77 KMT2A (0.58) GPR119CNR2KMT2ADRD2PANK3
SCHEMBL4958147 0.77 GPR119 (0.44) GPR119CNR2L3MBTL1KMT2ADRD2

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
WO-2008147763-A1 MMP INHIBITORS AND METHODS OF USE THEREOF ARRAY BIOPHARMA INC. (US) 2008-12-04 WO disclosed