SCHEMBL23523334

SCHEMBL23523334

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

nearest known ligand 0.76

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ BACE1 P56817 4/20 0.76
▸ APP P05067 4/20 0.76
▸ PTPN1 P18031 2/20 0.76
▸ PTGES O14684 2/20 0.70
▸ ALOX5 P09917 2/20 0.70
▸ PTGS1 P23219 1/20 0.70
▸ PTGS2 P35354 1/20 0.70
▸ MAOB P27338 5/20 0.67
▸ SLC6A3 Q01959 1/20 0.67
▸ TRPM7 Q96QT4 1/20 0.67
▸ DAGLA Q9Y4D2 1/20 0.67
▸ CNR2 P34972 1/20 0.65
▸ CTSL P07711 1/20 0.57
▸ MGAM O43451 1/20 0.56
▸ PPARG P37231 2/20 0.53
▸ PPARD Q03181 1/20 0.53
▸ PPARA Q07869 1/20 0.53
▸ DNMT1 P26358 1/20 0.53
▸ SIRT5 Q9NXA8 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
SCHEMBL23523338 1.00 BACE1 (0.76) BACE1APPPTPN1PTGESALOX5
SCHEMBL15363878 0.87 APP (0.97) BACE1APPPTPN1PTGESALOX5
SCHEMBL15363875 0.87 APP (0.97) BACE1APPPTPN1PTGESALOX5
SCHEMBL21710543 0.87 APP (0.97) BACE1APPPTPN1PTGESALOX5
SCHEMBL29770918 0.87 APP (0.97) BACE1APPPTPN1PTGESALOX5
Grifolic Acid SCHEMBL20819669 0.86 APP (1.00) BACE1APPPTPN1PTGESALOX5
SCHEMBL25560668 0.86 SLC6A3 (0.79) BACE1APPPTPN1PTGESALOX5
Grifolic Acid SCHEMBL12180037 0.86 APP (1.00) BACE1APPPTPN1PTGESALOX5
SCHEMBL25560778 0.85 SLC6A3 (0.74) BACE1APPPTPN1PTGESALOX5
SCHEMBL23523515 0.84 CNR2 (0.65) BACE1APPPTPN1PTGESALOX5

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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