SCHEMBL3659437

SCHEMBL3659437

CCCCC/C=C\C/C=C\CCCCCCCC(=O)OC(CC)OC(C)C

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.58
HPGD P15428 2/20 0.58
FAAH O00519 1/20 0.58
MAPT P10636 1/20 0.58
CNR1 P21554 1/20 0.58
CNR2 P34972 1/20 0.58
S1PR1 P21453 1/20 0.53
LMNA P02545 3/20 0.53
KDM4E B2RXH2 3/20 0.52
F7 P08709 3/20 0.52
F3 P13726 3/20 0.52
PPARG P37231 2/20 0.52
PPARD Q03181 2/20 0.52
PPARA Q07869 2/20 0.52
DUSP3 P51452 1/20 0.52
PTPN7 P35236 1/20 0.52
FFAR1 O14842 1/20 0.52
FABP3 P05413 1/20 0.52
CYP3A4 P08684 1/20 0.52
CYP19A1 P11511 1/20 0.52

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
SCHEMBL3659075 0.96 FAAH (0.63) ALDH1A1HPGDFAAHMAPTCNR1
SCHEMBL3659183 0.96 LMNA (0.57) ALDH1A1HPGDFAAHMAPTCNR1
SCHEMBL3658546 0.96 LMNA (0.57) ALDH1A1HPGDFAAHMAPTCNR1
SCHEMBL3658539 0.96 LMNA (0.57) ALDH1A1HPGDFAAHMAPTCNR1
SCHEMBL3662001 0.92 ALDH1A1 (0.58) ALDH1A1HPGDFAAHMAPTCNR1
SCHEMBL3658535 0.87 LMNA (0.68) ALDH1A1MAPTLMNATSHR
SCHEMBL3660740 0.87 LMNA (0.68) ALDH1A1MAPTLMNATSHR
SCHEMBL3657914 0.87 LMNA (0.68) ALDH1A1MAPTLMNATSHR
SCHEMBL3660844 0.87 LMNA (0.68) ALDH1A1MAPTLMNATSHR
SCHEMBL3656613 0.87 FFAR1 (0.62) FAAHLMNAFFAR1FFAR4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8425784-B2 Ozonolysis reactions in liquid CO2 and CO2-expanded solvents UNIVERSITY OF KANSAS (US) 2013-04-23 US claimed
EP-2209547-B1 OZONOLYSIS REACTIONS IN LIQUID CO2 AND CO2-EXPANDED SOLVENTS UNIV KANSAS (US) 2018-06-20 EP disclosed
US-8801939-B2 Ozonolysis reactions in liquid CO2 and CO2-expanded solvents UNIVERSITY OF KANSAS (US) 2014-08-12 US disclosed
US-20130240781-A1 Ozonolysis Reactions in Liquid CO2 and CO2-Expanded Solvents ARCHER DANIELS MIDLAND COMPANY (US) 2013-09-19 US disclosed
US-8425784-B2 Ozonolysis reactions in liquid CO2 and CO2-expanded solvents UNIVERSITY OF KANSAS (US) 2013-04-23 US disclosed
EP-2209547-A2 OZONOLYSIS REACTIONS IN LIQUID CO2 AND CO2-EXPANDED SOLVENTS University Of Kansas (US) 2010-07-28 EP disclosed
WO-2009061806-A2 OZONOLYSIS REACTIONS IN LIQUID CO2 AND CO2-EXPANDED SOLVENTS UNIVERSITY OF KANSAS (US) 2009-05-14 WO disclosed
US-20090118498-A1 OZONOLYSIS REACTIONS IN LIQUID CO2 AND CO2-EXPANDED SOLVENTS ARCHER DANIELS MIDLAND COMPANY 2009-05-07 US disclosed
US-4364743-A ESTER AND MIDDLE OIL ERNER WILLIAM E 1982-12-21 US disclosed