SCHEMBL28678334

SCHEMBL28678334

CCC=CCCC(O)CC=CCCCCCCCC(=O)OC

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 2/20 0.53
FFAR4 Q5NUL3 2/20 0.53
NFKB1 P19838 1/20 0.51
NFKB2 Q00653 1/20 0.51
RELA Q04206 1/20 0.51
ALDH1A1 P00352 5/20 0.50
FAAH O00519 2/20 0.50
CYP3A4 P08684 2/20 0.50
ALOX15 P16050 2/20 0.50
HSD17B10 Q99714 2/20 0.50
TDP1 Q9NUW8 2/20 0.50
TSHR P16473 1/20 0.50
EPHX2 P34913 1/20 0.50
LMNA P02545 2/20 0.46
DGKA P23743 1/20 0.46
L3MBTL1 Q9Y468 2/20 0.45
F7 P08709 2/20 0.44
F3 P13726 2/20 0.44
MAPT P10636 2/20 0.44
CYP19A1 P11511 2/20 0.44

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
SCHEMBL4854165 0.87 FFAR1 (0.66) FFAR1FFAR4NFKB1NFKB2RELA
SCHEMBL4854172 0.87 FFAR1 (0.66) FFAR1FFAR4NFKB1NFKB2RELA
SCHEMBL290360 0.86 FFAR1 (0.72) FFAR1FFAR4NFKB1NFKB2RELA
SCHEMBL2823784 0.86 FFAR1 (0.72) FFAR1FFAR4NFKB1NFKB2RELA
SCHEMBL8626686 0.86 FFAR1 (0.72) FFAR1FFAR4NFKB1NFKB2RELA
SCHEMBL25392604 0.86 FFAR1 (0.72) FFAR1FFAR4NFKB1NFKB2RELA
SCHEMBL1594097 0.86 FFAR1 (0.72) FFAR1FFAR4NFKB1NFKB2RELA
SCHEMBL18823716 0.86 FFAR1 (0.72) FFAR1FFAR4NFKB1NFKB2RELA
SCHEMBL8945069 0.86 FFAR1 (0.72) FFAR1FFAR4NFKB1NFKB2RELA
SCHEMBL445374 0.86 FFAR1 (0.72) FFAR1FFAR4NFKB1NFKB2RELA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116640612-A Fuel additive, preparation method thereof and fuel composition 中国石油化工股份有限公司 2023-08-25 CN claimed
CN-113845946-A Fuel additive, preparation method thereof and fuel composition 中国石油化工股份有限公司 2021-12-28 CN claimed