SCHEMBL3311540

SCHEMBL3311540

CCC(=O)OC=COC=COC=COC(=O)CC

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.36
NAAA Q02083 1/20 0.33
TDP1 Q9NUW8 2/20 0.32
FFAR3 O14843 1/20 0.32
MGAM O43451 1/20 0.31
GAA P10253 1/20 0.31
SI P14410 1/20 0.31
MGAM2 Q2M2H8 1/20 0.31
SOAT1 P35610 1/20 0.31
TSHR P16473 1/20 0.31
CYP1A2 P05177 1/20 0.30
HPGD P15428 1/20 0.30
CYP2C19 P33261 1/20 0.30
BLM P54132 1/20 0.30
WRN Q14191 1/20 0.30
HIF1A Q16665 1/20 0.30

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
SCHEMBL2437586 0.79
SCHEMBL96532 0.79
SCHEMBL2437008 0.77
SCHEMBL2437006 0.77
SCHEMBL27292133 0.77
SCHEMBL31297141 0.75 MGAM (0.50) MGAMGAASIMGAM2TSHR
SCHEMBL30033082 0.75
SCHEMBL4839246 0.75 ALDH1A1 (0.41) ALDH1A1NAAATDP1FFAR3MGAM
SCHEMBL5177208 0.73
SCHEMBL21679515 0.73 ALDH1A1 (0.32) ALDH1A1NAAATDP1

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
US-8603730-B2 Photopolymerisable composition XETOS AG (DE) 2013-12-10 US disclosed
US-20100112458-A1 Photopolymerisable composition XETOS AG (DE) 2010-05-06 US disclosed