SCHEMBL28852820

SCHEMBL28852820

CC(C)=CCC/C(C)=C/Cc1ccccc1C=Cc1ccccc1

nearest known ligand 0.62

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ PPARG P37231 12/20 0.62
▸ PPARA Q07869 12/20 0.62
▸ OSBP P22059 1/20 0.47
▸ PGR P06401 1/20 0.43
▸ HTR1A P08908 1/20 0.43
▸ ADORA3 P0DMS8 1/20 0.43
▸ MAPT P10636 1/20 0.43
▸ PTGS1 P23219 1/20 0.43
▸ PDE4A P27815 1/20 0.43
▸ MAPK1 P28482 1/20 0.43
▸ DRD3 P35462 1/20 0.43
▸ SNCA P37840 1/20 0.43
▸ PDE3A Q14432 1/20 0.43
▸ PTGER4 P35408 1/20 0.43
▸ PTGER3 P43115 1/20 0.43
▸ PTGER2 P43116 1/20 0.43

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
SCHEMBL4822382 1.00 PPARG (0.62) PPARGPPARAOSBPPGRHTR1A
SCHEMBL4822390 1.00 PPARG (0.62) PPARGPPARAOSBPPGRHTR1A
Hydroquinone SCHEMBL7592245 0.95 PPARG (0.60) PPARGPPARAOSBPMAPT
Hydroquinone SCHEMBL7592243 0.95 PPARG (0.60) PPARGPPARAOSBPMAPT
SCHEMBL28852849 0.87 PTGER4 (0.50) PPARGPPARAPTGS1PTGER4PTGER3
SCHEMBL3275092 0.84 PTGER3 (0.53) PPARGPPARAPGRHTR1AADORA3
SCHEMBL30739304 0.81 MAPT (0.45) PPARGPPARAPGRHTR1AADORA3
SCHEMBL27963663 0.81 MAPT (0.45) PPARGPPARAPGRHTR1AADORA3
SCHEMBL11811458 0.79 PGR (0.44) PPARGPPARAOSBPPGRHTR1A
SCHEMBL27706696 0.78 MAPT (0.58) PPARGPPARAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112789505-B Biosynthetic platforms for the production of cannabinoids and other prenylated compounds 加利福尼亚大学董事会 2024-04-09 — — CN disclosed
CN-115003823-A Biosynthetic platform for the production of cannabinoids and other prenylated compounds 加利福尼亚大学董事会 2022-09-02 — — CN disclosed
CN-112789505-A Biosynthetic platform for the production of cannabinoids and other prenylated compounds 加利福尼亚大学董事会 2021-05-11 — — CN disclosed
Send feedback