SCHEMBL7202011

SCHEMBL7202011

CCCCc1ccccc1-c1c(N)ccc2ccccc12

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TLR8 Q9NR97 4/20 0.42
CNR2 P34972 1/20 0.40
TLR7 Q9NYK1 1/20 0.38
HSD11B1 P28845 1/20 0.38
GAA P10253 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
CNR1 P21554 2/20 0.36
NCEH1 Q6PIU2 1/20 0.36
BCHE P06276 1/20 0.36
TAAR1 Q96RJ0 1/20 0.35
DNMT1 P26358 1/20 0.35

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
SCHEMBL7189130 0.96 TLR8 (0.43) TLR8CNR2GAACNR1
SCHEMBL7190389 0.94 TLR8 (0.43) TLR8CNR2GAACNR1
SCHEMBL7194266 0.94 TLR8 (0.43) TLR8CNR2GAACNR1
SCHEMBL1606156 0.94 TLR8 (0.43) TLR8CNR2GAACNR1
SCHEMBL7191432 0.94 TLR8 (0.43) TLR8CNR2GAACNR1
SCHEMBL1992947 0.81 TLR8 (0.43) TLR8CNR2TLR7GAATDP1
SCHEMBL1990277 0.77 TLR8 (0.44) TLR8CNR2GAACNR1
Phosphine SCHEMBL28863280 0.76 CNR2 (0.46) TLR8CNR2TLR7CNR1BCHE
SCHEMBL3725184 0.76 LIPG (0.41) TLR8CNR2
SCHEMBL1994553 0.75 CNR1 (0.45) TLR8CNR2GAACNR1

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 3 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
EP-0778334-A1 HEAT-RESISTANT LUBRICATING OIL COMPOSITION Tonen Corporation (JP) 1997-06-11 EP disclosed