SCHEMBL23388293

SCHEMBL23388293

CC(=CCCC1COC(=O)O1)C(=O)O

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CD81 P60033 2/20 0.35
PPARG P37231 1/20 0.34
HTT P42858 1/20 0.33
SLC22A12 Q96S37 10/20 0.33
SLC2A9 Q9NRM0 1/20 0.31
BACE1 P56817 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
SCHEMBL23388296 0.91 CD81 (0.33) CD81PPARGHTTSLC22A12
SCHEMBL4397870 0.90 TBXAS1 (0.34) CD81PPARGHTTSLC22A12
SCHEMBL4397865 0.90 TBXAS1 (0.34) CD81PPARGHTTSLC22A12
SCHEMBL245246 0.84 SLC22A12 (0.32) CD81PPARGSLC22A12
SCHEMBL444796 0.79 CD81 (0.41) CD81PPARG
SCHEMBL475004 0.79 CD81 (0.41) CD81PPARG
SCHEMBL10589816 0.75 HTT (0.35) HTT
Propylene Carbonate SCHEMBL29778073 0.74 ALDH1A1 (0.30)
SCHEMBL13116193 0.72 HTT (0.31) HTT
SCHEMBL14053447 0.72 FAAH (0.33)

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
WO-2021099943-A1 RADIATION CURABLE INKJET INK, DECORATIVE SHEET, AND METHOD OF PRODUCING DECORATIVE SHEET 3M INNOVATIVE PROPERTIES COMPANY (US) 2021-05-27 WO disclosed