SCHEMBL27718980

SCHEMBL27718980

CCCCCCCCc1c(N)c(C)c2nn[nH]c2c1CCCCCCCC

nearest known ligand 0.37

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.35
TLR8 Q9NR97 3/20 0.33
TLR7 Q9NYK1 1/20 0.33
MAPT P10636 1/20 0.32
TDP1 Q9NUW8 1/20 0.30
SRC P12931 1/20 0.30

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
SCHEMBL27855861 1.00 ALDH1A1 (0.35) ALDH1A1TLR8TLR7MAPTTDP1
SCHEMBL27872510 1.00 ALDH1A1 (0.35) ALDH1A1TLR8TLR7MAPTTDP1
SCHEMBL27855849 1.00 ALDH1A1 (0.35) ALDH1A1TLR8TLR7MAPTTDP1
SCHEMBL27855896 1.00 ALDH1A1 (0.35) ALDH1A1TLR8TLR7MAPTTDP1
SCHEMBL27855886 0.89 NOS2 (0.31)
SCHEMBL27936983 0.87 ALDH1A1 (0.34) ALDH1A1TLR8TLR7MAPT
SCHEMBL27950724 0.87 ALDH1A1 (0.34) ALDH1A1TLR8TLR7MAPT
SCHEMBL27936980 0.87 ALDH1A1 (0.34) ALDH1A1TLR8TLR7MAPT
SCHEMBL27855848 0.87 ALDH1A1 (0.34) ALDH1A1TLR8TLR7MAPT
SCHEMBL27872507 0.87 ALDH1A1 (0.34) ALDH1A1TLR8TLR7MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103589486-A Refrigerant oil and operating fluid composition for freezer JX NIPPON OIL & ENERGY CORP 2014-02-19 CN disclosed
CN-101300330-B Lubricating oil composition NIPPON OIL CORP 2012-10-10 CN disclosed
CN-102533392-A Working fluid composition for refrigerator machine and refrigerating machine oil JX NIPPON OIL & ENERGY CORP 2012-07-04 CN disclosed
CN-102482611-A Refrigerator oil and working fluid composition for refrigerator JX NIPPON OIL & ENERGY CORP 2012-05-30 CN disclosed
CN-101300330-A Lubricating oil composition NIPPON OIL CORP (JP) 2008-11-05 CN disclosed