SCHEMBL7189130

SCHEMBL7189130

CCCCCc1ccccc1-c1c(N)ccc2ccccc12

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TLR8 Q9NR97 11/20 0.43
CNR1 P21554 2/20 0.40
NR1H2 P55055 1/20 0.40
NR1H3 Q13133 1/20 0.40
LIPG Q9Y5X9 1/20 0.40
CNR2 P34972 1/20 0.39
GCGR P47871 1/20 0.39
KDM4E B2RXH2 1/20 0.38
USP2 O75604 1/20 0.38
ALDH1A1 P00352 1/20 0.38
GLA P06280 1/20 0.38
CYP3A4 P08684 1/20 0.38
GAA P10253 1/20 0.38
MAPT P10636 1/20 0.38
HPGD P15428 1/20 0.38
CASP1 P29466 1/20 0.38
CASP7 P55210 1/20 0.38
HSD17B10 Q99714 1/20 0.38
PARP1 P09874 1/20 0.37

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
SCHEMBL7190389 0.99 TLR8 (0.43) TLR8CNR1NR1H2NR1H3LIPG
SCHEMBL7191432 0.99 TLR8 (0.43) TLR8CNR1NR1H2NR1H3LIPG
SCHEMBL7194266 0.99 TLR8 (0.43) TLR8CNR1NR1H2NR1H3LIPG
SCHEMBL1606156 0.99 TLR8 (0.43) TLR8CNR1NR1H2NR1H3LIPG
SCHEMBL7202011 0.96 TLR8 (0.42) TLR8CNR1CNR2GAA
SCHEMBL1990277 0.81 TLR8 (0.44) TLR8CNR1NR1H2NR1H3LIPG
SCHEMBL1994553 0.80 CNR1 (0.45) TLR8CNR1NR1H2NR1H3LIPG
SCHEMBL7549186 0.80 CNR1 (0.45) TLR8CNR1NR1H2NR1H3LIPG
SCHEMBL8915572 0.80 CNR1 (0.45) TLR8CNR1NR1H2NR1H3LIPG
SCHEMBL1990197 0.80 CNR1 (0.45) TLR8CNR1NR1H2NR1H3LIPG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6586376-B1 Sterically hindered polyol ester and polyphenyl thioether, oxidation resistance; jet turbine engines EXXONMOBIL RESEARCH AND ENGINEERING COMPANY 2003-07-01 US disclosed
US-6191080-B1 MIXTURE OF POLYOL ESTERS, MIXTURE OF POLYPHENYLENE ETHER AND POLYOL ESTER AND POLYPHENYLENE THIOETHERS TONEN CORPORATION (JP) 2001-02-20 US disclosed
US-6147035-A DETERGENCY; HEAT AND OXIDATION RESISTANCE; REDUCE NITROGEN OXIDE EMISSION TONEN CORPORATION (JP) 2000-11-14 US disclosed
EP-0778334-A1 HEAT-RESISTANT LUBRICATING OIL COMPOSITION Tonen Corporation (JP) 1997-06-11 EP disclosed