SCHEMBL1668443

SCHEMBL1668443

CCCCCCCCc1ccc(N)c2ccccc12

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LIPG Q9Y5X9 1/20 0.47
MAPT P10636 3/20 0.47
CYP3A4 P08684 2/20 0.47
KDM4E B2RXH2 1/20 0.47
USP2 O75604 1/20 0.47
ALDH1A1 P00352 1/20 0.47
GLA P06280 1/20 0.47
GAA P10253 1/20 0.47
HPGD P15428 1/20 0.47
CASP1 P29466 1/20 0.47
CASP7 P55210 1/20 0.47
HSD17B10 Q99714 1/20 0.47
TLR8 Q9NR97 9/20 0.44
PARP1 P09874 1/20 0.43
CHEK1 O14757 1/20 0.43
NEK2 P51955 1/20 0.43
LIMK1 P53667 1/20 0.43
DYRK1A Q13627 1/20 0.43
CLK4 Q9HAZ1 1/20 0.43
TYR P14679 2/20 0.42

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
SCHEMBL5748550 1.00 LIPG (0.47) LIPGMAPTCYP3A4KDM4EUSP2
SCHEMBL293357 1.00 LIPG (0.47) LIPGMAPTCYP3A4KDM4EUSP2
SCHEMBL28931216 0.93 TLR8 (0.44) MAPTCYP3A4KDM4EUSP2ALDH1A1
SCHEMBL5745523 0.89 TLR8 (0.50) LIPGCYP3A4ALDH1A1HPGDHSD17B10
SCHEMBL30217449 0.89 TLR8 (0.50) LIPGCYP3A4ALDH1A1HPGDHSD17B10
SCHEMBL5748397 0.89 TLR8 (0.50) LIPGCYP3A4ALDH1A1HPGDHSD17B10
SCHEMBL5745315 0.89 TLR8 (0.50) LIPGCYP3A4ALDH1A1HPGDHSD17B10
SCHEMBL11779245 0.89 LIPG (0.57) LIPGMAPTCYP3A4KDM4EUSP2
SCHEMBL30537736 0.89 LIPG (0.57) LIPGMAPTCYP3A4KDM4EUSP2
SCHEMBL3677393 0.87 LIPG (0.53) LIPGMAPTCYP3A4KDM4EUSP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4110234-A PHENYLATED NAPHTHYLAMINE, SULFUR COMPOUND, METAL UNIROYAL, INC. (US) 1978-08-29 US claimed
US-8367593-B2 Method for improving the resistance to one or more of corrosion, oxidation, sludge and deposit formation of lubricating oil compositions for biodiesel fueled engines EXXONMOBIL RESEARCH AND ENGINEERING COMPANY (US) 2013-02-05 US disclosed
EP-2483373-A1 METHOD FOR IMPROVING CORROSION RESISTANCE OF BIODIESEL FUELED ENGINES ExxonMobil Research and Engineering Company (US) 2012-08-08 EP disclosed
US-20110130316-A1 METHOD FOR IMPROVING THE RESISTANCE TO ONE OR MORE OF CORROSION, OXIDATION, SLUDGE AND DEPOSIT FORMATION OF LUBRICATING OIL COMPOSITIONS FOR BIODIESEL FUELED ENGINES EXXONMOBIL RESEARCH AND ENGINEERING COMPANY (US) 2011-06-02 US disclosed
WO-2011041346-A1 METHOD FOR IMPROVING CORROSION RESISTANCE OF BIODIESEL FUELED ENGINES EXXONMOBIL RESEARCH AND ENGINEERING COMPANY (US) 2011-04-07 WO disclosed
US-20060293503-A1 Polyaminopyridines and method for producing same SUMITOMO SEIKA CHEMICALS CO., LTD (JP) 2006-12-28 US disclosed
EP-1669390-A1 POLYAMINOPYRIDINES AND METHOD FOR PRODUCING SAME SUMITOMO SEIKA CHEMICALS CO., LTD. (JP) 2006-06-14 EP disclosed