SCHEMBL3661757

SCHEMBL3661757

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

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.64
CYP3A4 P08684 2/20 0.64
ALOX15 P16050 2/20 0.64
HSD17B10 Q99714 2/20 0.64
TDP1 Q9NUW8 2/20 0.64
TSHR P16473 1/20 0.64
MAPT P10636 3/20 0.58
F7 P08709 3/20 0.58
F3 P13726 3/20 0.58
CYP19A1 P11511 3/20 0.58
NR1I2 O75469 2/20 0.58
PTGS2 P35354 2/20 0.58
HPGD P15428 2/20 0.58
OXER1 Q8TDS5 2/20 0.58
PTGS1 P23219 2/20 0.58
PPARG P37231 2/20 0.58
KMT2A Q03164 2/20 0.58
PPARD Q03181 2/20 0.58
PPARA Q07869 2/20 0.58
KDM4E B2RXH2 2/20 0.58

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
SCHEMBL3660035 0.91 ALDH1A1 (0.63) ALDH1A1CYP3A4ALOX15HSD17B10TDP1
SCHEMBL29454642 0.90 ALDH1A1 (0.62) ALDH1A1CYP3A4ALOX15HSD17B10TDP1
SCHEMBL27893799 0.88 ALDH1A1 (0.68) ALDH1A1CYP3A4ALOX15HSD17B10TDP1
SCHEMBL3654529 0.87 ALDH1A1 (0.66) ALDH1A1CYP3A4ALOX15HSD17B10TDP1
SCHEMBL3657904 0.86 PRKCA (0.59) ALDH1A1CYP3A4ALOX15HSD17B10MAPT
SCHEMBL769154 0.86 PRKCA (0.59) ALDH1A1CYP3A4ALOX15HSD17B10MAPT
SCHEMBL3658519 0.86 PRKCA (0.59) ALDH1A1CYP3A4ALOX15HSD17B10MAPT
SCHEMBL27982734 0.85 ALDH1A1 (0.64) ALDH1A1CYP3A4ALOX15HSD17B10TDP1
SCHEMBL28780344 0.85 ALDH1A1 (0.57) ALDH1A1CYP3A4ALOX15HSD17B10TDP1
SCHEMBL1496221 0.85 ALDH1A1 (0.68) ALDH1A1CYP3A4ALOX15HSD17B10TDP1

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 10 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
CN-101909729-B Ozonolysis reactions in liquid CO2 and CO2-expanded solvents UNIVERSITY OF KANSAS (US) 2014-10-22 CN 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