SCHEMBL7076109

SCHEMBL7076109

CCCCC=C(CCCC)OC(=CCCCC)CCCC

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.35
TSHR P16473 2/20 0.35
CES1 P23141 2/20 0.35
CES2 O00748 1/20 0.35
EP300 Q09472 1/20 0.34
F7 P08709 1/20 0.33
F3 P13726 1/20 0.33
TP53 P04637 1/20 0.32
GRIK1 P39086 1/20 0.32
CA1 P00915 1/20 0.31

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
SCHEMBL7076108 1.00 ALDH1A1 (0.35) ALDH1A1TSHRCES1CES2EP300
SCHEMBL11005612 0.86 EP300 (0.45) EP300F7F3TP53
SCHEMBL11005625 0.86 EP300 (0.45) EP300F7F3TP53
SCHEMBL11130016 0.86 EP300 (0.45) EP300F7F3TP53
SCHEMBL11130007 0.86 EP300 (0.45) EP300F7F3TP53
SCHEMBL11805820 0.86 EP300 (0.45) EP300F7F3TP53
SCHEMBL1502818 0.86 EP300 (0.45) EP300F7F3TP53
SCHEMBL11293823 0.86 CES1 (0.39) ALDH1A1TSHRCES1CES2EP300
SCHEMBL11752411 0.85 TSHR (0.38) ALDH1A1TSHREP300F7F3
SCHEMBL11752417 0.85 TSHR (0.38) ALDH1A1TSHREP300F7F3

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
US-20030090023-A1 Method of manufacturing composite molded product, including coating for insert material with dope cement before insert molding YAMAHA CORPORATION (JP) 2003-05-15 US disclosed