SCHEMBL28115840

SCHEMBL28115840

CCCCCCCCc1ccc(C(=O)OO)c(C(=O)OO)c1CCCCCCCC

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 4/20 0.44
PPARG P37231 3/20 0.42
TSHR P16473 3/20 0.42
TYR P14679 2/20 0.42
MEN1 O00255 1/20 0.42
TP53 P04637 1/20 0.42
CYP3A4 P08684 1/20 0.42
ALOX5 P09917 1/20 0.42
MAPT P10636 1/20 0.42
ALOX15 P16050 1/20 0.42
HTT P42858 1/20 0.42
KMT2A Q03164 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
BID P55957 3/20 0.40
MCL1 Q07820 3/20 0.40
BCL2L1 Q07817 2/20 0.40
BAK1 Q16611 2/20 0.40
KAT8 Q9H7Z6 2/20 0.40
EP300 Q09472 1/20 0.40
KAT2A Q92830 1/20 0.40

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
SCHEMBL7190804 0.94 TYR (0.39) PPARAPPARGTSHRTYRMEN1
SCHEMBL27951175 0.86 PPARA (0.44) PPARAPPARGTSHRTYRMEN1
SCHEMBL7190798 0.86 METAP2 (0.41) PPARAPPARGTYRMEN1KMT2A
SCHEMBL7190813 0.86 PPARA (0.44) PPARAPPARGTYRBIDMCL1
SCHEMBL28247885 0.86 KDM4E (0.46) PPARAPPARGTSHRTYRTP53
SCHEMBL28649757 0.86 PPARA (0.44) PPARAPPARGTSHRTYRMEN1
SCHEMBL28930928 0.84 PPARA (0.40) PPARAPPARGTSHRTYRMEN1
SCHEMBL4516539 0.83 TSHR (0.52) TSHRTP53CYP3A4MAPTTDP1
SCHEMBL10601909 0.83 ALDH1A1 (0.56) TSHRTP53CYP3A4MAPTTDP1
SCHEMBL29055455 0.83 ALDH1A1 (0.56) TSHRTP53CYP3A4MAPTTDP1

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
CN-103013107-B A kind of liquid crystal polymer is as the purposes of high polymer high-temperature lubricant 合肥杰事杰新材料股份有限公司 2016-12-21 CN disclosed