SCHEMBL8780826

SCHEMBL8780826

CCN(CCCc1cc(=O)n(C)c(=O)n1C)CC(C)O

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 1/20 0.38
NPSR1 Q6W5P4 2/20 0.35
POLB P06746 1/20 0.35
TSHR P16473 1/20 0.35
HSD17B10 Q99714 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
ALDH1A1 P00352 2/20 0.34
PLA2G7 Q13093 1/20 0.34
SLC22A2 O15244 1/20 0.34
ADRB1 P08588 1/20 0.34
SLC6A4 P31645 1/20 0.34
KCNH2 Q12809 1/20 0.34
SLC47A2 Q86VL8 1/20 0.34
SLC47A1 Q96FL8 1/20 0.34
MAPT P10636 1/20 0.33
CYP1A2 P05177 1/20 0.33
PKM P14618 1/20 0.32
MAPK1 P28482 1/20 0.32
RXFP1 Q9HBX9 2/20 0.31

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
SCHEMBL8780905 0.83 GPR84 (0.40) GPR84NPSR1TSHRHSD17B10L3MBTL1
SCHEMBL8780827 0.83 SLC6A4 (0.44) GPR84NPSR1HSD17B10ALDH1A1SLC22A2
SCHEMBL8780897 0.76 SLC22A2 (0.46) GPR84NPSR1TSHRHSD17B10ALDH1A1
SCHEMBL8780869 0.75 KCNH2 (0.42) GPR84SLC22A2ADRB1SLC6A4KCNH2
SCHEMBL8780779 0.75 KCNH2 (0.51) ALDH1A1SLC22A2ADRB1SLC6A4KCNH2
SCHEMBL8780948 0.74 SLC22A2 (0.39) GPR84NPSR1HSD17B10ALDH1A1SLC22A2
SCHEMBL8780903 0.74 KCNH2 (0.38) GPR84SLC22A2ADRB1SLC6A4KCNH2
SCHEMBL8780858 0.73 ALDH1A1 (0.44) POLBALDH1A1SLC22A2ADRB1SLC6A4
SCHEMBL8780878 0.72 SLC6A4 (0.43) SLC6A4KCNH2
SCHEMBL8780919 0.72 HRH3 (0.41) KCNH2PKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0697407-B1 Pyrimidinedione derivatives and antiarrhythmic compositions containing same MITSUI TOATSU CHEMICALS (JP) 1997-06-25 EP disclosed
EP-0697407-A1 Pyrimidinedione derivatives and antiarrhythmic compositions containing same MITSUI TOATSU CHEMICALS, Inc. (JP) 1996-02-21 EP disclosed