SCHEMBL7754867

SCHEMBL7754867

CCCCC=C(C)C(=O)OC(=O)C(C)=CCCCC

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
EP300 Q09472 1/20 0.41
TSHR P16473 3/20 0.37
GRIK1 P39086 1/20 0.37
ALDH1A1 P00352 1/20 0.37
F7 P08709 1/20 0.35
F3 P13726 1/20 0.35
ATM Q13315 1/20 0.34
CYP2D6 P10635 1/20 0.34
CYP2C19 P33261 1/20 0.34
FAAH O00519 3/20 0.33
NAAA Q02083 1/20 0.33
CES1 P23141 1/20 0.33
PTGS2 P35354 1/20 0.33

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
SCHEMBL5459895 0.96 EP300 (0.47) EP300F7F3ATMCYP2C19
SCHEMBL1001904 0.94 EP300 (0.37) EP300TSHRGRIK1ALDH1A1F7
SCHEMBL15251310 0.94 EP300 (0.50) EP300TSHRF7F3ATM
SCHEMBL5461045 0.94 EP300 (0.37) EP300TSHRGRIK1ALDH1A1F7
SCHEMBL7613779 0.92 EP300 (0.36) EP300TSHRGRIK1ALDH1A1F7
SCHEMBL14890135 0.92 EP300 (0.52) EP300TSHRF7F3ATM
SCHEMBL9242927 0.92 EP300 (0.52) EP300TSHRF7F3ATM
SCHEMBL3433546 0.92 EP300 (0.52) EP300TSHRF7F3ATM
SCHEMBL3437706 0.92 EP300 (0.52) EP300TSHRF7F3ATM
SCHEMBL9656545 0.92 EP300 (0.52) EP300TSHRF7F3ATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0870549-B1 METALLIC SHEET HAVING RUST-PREVENTIVE ORGANIC COATING THEREON, PROCESS FOR THE PRODUCTION THEREOF AND TREATING FLUID THEREFOR NIPPON STEEL CORP (JP) 2001-03-21 EP disclosed