SCHEMBL23523459

SCHEMBL23523459

CC(C)=CCC/C(C)=C/Cc1c(O)cc(CC(=O)O)c(C(=O)O)c1O

nearest known ligand 0.72

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ SLC6A3 Q01959 1/20 0.72
▸ TRPM7 Q96QT4 1/20 0.72
▸ DAGLA Q9Y4D2 1/20 0.72
▸ CNR2 P34972 1/20 0.71
▸ BACE1 P56817 3/20 0.71
▸ APP P05067 3/20 0.71
▸ PTPN1 P18031 2/20 0.71
▸ PTGES O14684 1/20 0.66
▸ ALOX5 P09917 1/20 0.66
▸ PTGS1 P23219 1/20 0.66
▸ PTGS2 P35354 1/20 0.66
▸ MAOB P27338 5/20 0.63
▸ PPARG P37231 2/20 0.55
▸ PPARD Q03181 1/20 0.55
▸ PPARA Q07869 1/20 0.55
▸ DNMT1 P26358 1/20 0.55
▸ SIRT5 Q9NXA8 1/20 0.55
▸ CTSL P07711 1/20 0.54
▸ MGAM O43451 1/20 0.53

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
SCHEMBL23523461 1.00 SLC6A3 (0.72) SLC6A3TRPM7DAGLACNR2BACE1
SCHEMBL25560668 0.90 SLC6A3 (0.79) SLC6A3TRPM7DAGLACNR2BACE1
SCHEMBL23523284 0.89 SLC6A3 (0.78) SLC6A3TRPM7DAGLACNR2BACE1
SCHEMBL23523285 0.89 SLC6A3 (0.78) SLC6A3TRPM7DAGLACNR2BACE1
SCHEMBL25560778 0.89 SLC6A3 (0.74) SLC6A3TRPM7DAGLACNR2BACE1
SCHEMBL23523413 0.87 SLC6A3 (0.82) SLC6A3TRPM7DAGLACNR2BACE1
SCHEMBL23523416 0.87 SLC6A3 (0.82) SLC6A3TRPM7DAGLACNR2BACE1
SCHEMBL19714693 0.87 SLC6A3 (0.85) SLC6A3TRPM7DAGLACNR2BACE1
SCHEMBL13214111 0.87 SLC6A3 (0.85) SLC6A3TRPM7DAGLACNR2BACE1
SCHEMBL29530411 0.87 SLC6A3 (0.85) SLC6A3TRPM7DAGLACNR2BACE1

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-20210189444-A1 METHOD OF PURIFYING CANNABINOIDS FROM YEAST FERMENTATION BROTH DEMETRIX, INC. 2021-06-24 — — US disclosed
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