SCHEMBL3661698

SCHEMBL3661698

CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)OCC(CC)CCCC

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 2/20 0.68
TDP1 Q9NUW8 2/20 0.68
TSHR P16473 1/20 0.68
ATM Q13315 1/20 0.68
FAAH O00519 5/20 0.66
MGLL Q99685 1/20 0.60
CNR1 P21554 3/20 0.59
ALDH1A1 P00352 3/20 0.59
MAPT P10636 3/20 0.59
THRB P10828 1/20 0.59
HPGD P15428 2/20 0.56
CNR2 P34972 1/20 0.56
DGKA P23743 1/20 0.54
PRKCE Q02156 1/20 0.52
PRKCQ Q04759 1/20 0.52
PRKCD Q05655 1/20 0.52
PRKCA P17252 1/20 0.52
PPARG P37231 2/20 0.51
KDM4E B2RXH2 1/20 0.51
MEN1 O00255 1/20 0.51

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
SCHEMBL3661702 1.00 CYP3A4 (0.68) CYP3A4TDP1TSHRATMFAAH
SCHEMBL12431709 0.96 CYP3A4 (0.71) CYP3A4TDP1TSHRATMFAAH
SCHEMBL2866595 0.96 CYP3A4 (0.71) CYP3A4TDP1TSHRATMFAAH
SCHEMBL28881165 0.92 TDP1 (0.77) CYP3A4TDP1TSHRATMFAAH
SCHEMBL9838605 0.92 TDP1 (0.77) CYP3A4TDP1TSHRATMFAAH
SCHEMBL10657519 0.92 TDP1 (0.77) CYP3A4TDP1TSHRATMFAAH
SCHEMBL333602 0.92 TDP1 (0.77) CYP3A4TDP1TSHRATMFAAH
SCHEMBL9838603 0.92 TDP1 (0.77) CYP3A4TDP1TSHRATMFAAH
SCHEMBL3659727 0.92 TDP1 (0.77) CYP3A4TDP1TSHRATMFAAH
SCHEMBL27342818 0.92 TDP1 (0.77) CYP3A4TDP1TSHRATMFAAH

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 13 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-4733360-A1 VULCANIZING AGENT COMPOSITION AND PRODUCTION METHOD FOR SAME, RUBBER COMPOSITION AND PRODUCTION METHOD FOR SAME, AND VULCANIZED RUBBER AND PRODUCTION METHOD FOR SAME SHIKOKU CHEMICALS CORPORATION (JP) 2026-04-29 EP disclosed
WO-2024262346-A1 VULCANIZING AGENT COMPOSITION AND PRODUCTION METHOD FOR SAME, RUBBER COMPOSITION AND PRODUCTION METHOD FOR SAME, AND VULCANIZED RUBBER AND PRODUCTION METHOD FOR SAME 四国化成工業株式会社 2024-12-26 WO disclosed
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-20030054103-A1 Curable coating composition, curable ink, printing method thereof and printed matter TOYO INK MFG. CO., LTD. (JP) 2003-03-20 US disclosed
US-4364743-A ESTER AND MIDDLE OIL ERNER WILLIAM E 1982-12-21 US disclosed