SCHEMBL5465489

SCHEMBL5465489

CCCCCCc1cc2[nH]nnc2c(CC)c1N

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TLR8 Q9NR97 8/20 0.33
ALDH1A1 P00352 2/20 0.32
CYP3A4 P08684 2/20 0.32
MAPT P10636 2/20 0.32
KDM4E B2RXH2 1/20 0.32
USP2 O75604 1/20 0.32
GLA P06280 1/20 0.32
GAA P10253 1/20 0.32
HPGD P15428 1/20 0.32
CASP1 P29466 1/20 0.32
CASP7 P55210 1/20 0.32
HSD17B10 Q99714 1/20 0.32
GPR84 Q9NQS5 1/20 0.32
MEN1 O00255 1/20 0.31
TP53 P04637 1/20 0.31
ALOX5 P09917 1/20 0.31
TYR P14679 1/20 0.31
ALOX15 P16050 1/20 0.31
TSHR P16473 1/20 0.31
HTT P42858 1/20 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
SCHEMBL5466831 1.00 TLR8 (0.33) TLR8ALDH1A1CYP3A4MAPTKDM4E
SCHEMBL5450697 1.00 TLR8 (0.33) TLR8ALDH1A1CYP3A4MAPTKDM4E
SCHEMBL5460084 1.00 TLR8 (0.33) TLR8ALDH1A1CYP3A4MAPTKDM4E
SCHEMBL5449275 1.00 TLR8 (0.33) TLR8ALDH1A1CYP3A4MAPTKDM4E
SCHEMBL5444831 1.00 TLR8 (0.33) TLR8ALDH1A1CYP3A4MAPTKDM4E
SCHEMBL5450687 1.00 TLR8 (0.33) TLR8ALDH1A1CYP3A4MAPTKDM4E
SCHEMBL5459926 0.99 TLR8 (0.34) TLR8ALDH1A1CYP3A4MAPTKDM4E
SCHEMBL5450709 0.94 TLR8 (0.33) TLR8ALDH1A1KDM4ETP53TSHR
SCHEMBL5448242 0.89 KDM4E (0.35) ALDH1A1KDM4E
SCHEMBL5460077 0.85 TLR8 (0.34) TLR8ALDH1A1CYP3A4MAPTKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8796193-B2 Refrigerating machine oil compositions NIPPON OIL CORPORATION (JP) 2014-08-05 US disclosed
CN-1930276-B Refrigerating machine oil composition NIPPON OIL CORP 2010-08-04 CN disclosed
CN-100593563-C Refrigerating machine oil NIPPON OIL CORP 2010-03-10 CN disclosed
US-20070155635-A1 Refrigerating machine oil compositions NIPPON OIL CORPORATION (JP) 2007-07-05 US disclosed
CN-1938408-A Lubricating composition for industrial machinery NIPPON OIL CORP (JP) 2007-03-28 CN disclosed
CN-1930274-A Refrigerating machine oil NIPPON OIL CORP (JP) 2007-03-14 CN disclosed
CN-1930276-A Refrigerating machine oil composition NIPPON OIL CORP (JP) 2007-03-14 CN disclosed
CN-1214093-C Turbine oil composition NIPPON MITSUBISHI OIL CORP (JP) 2005-08-10 CN disclosed
CN-1227258-A Turbine oil composition NIPPON OIL CO LTD (JP) 1999-09-01 CN disclosed