SCHEMBL8021149

SCHEMBL8021149

C/C(=C\CC/C(C)=C/CC/C(C)=C/Cc1cc(C=O)ccc1O)C/C=C/C(C)(C)O

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PPARG P37231 5/20 0.47
PPARA Q07869 5/20 0.47
BACE1 P56817 3/20 0.46
DHODH Q02127 2/20 0.41
MAOB P27338 2/20 0.40
OSBP P22059 1/20 0.39
ALOX5 P09917 1/20 0.38
ALOX15 P16050 1/20 0.38
AKR1B10 O60218 1/20 0.38
AKR1B1 P15121 1/20 0.38
AKR1C3 P42330 1/20 0.38
PTPN1 P18031 1/20 0.38

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
SCHEMBL8027818 0.85 BACE1 (0.46) BACE1DHODHMAOBOSBPALOX5
SCHEMBL8027423 0.84 BACE1 (0.67) BACE1DHODHMAOBALOX5ALOX15
SCHEMBL8011239 0.82 PPARG (0.62) PPARGPPARABACE1MAOBOSBP
SCHEMBL8009546 0.82 PPARG (0.62) PPARGPPARABACE1MAOBOSBP
SCHEMBL8011251 0.81 PPARG (0.63) PPARGPPARABACE1MAOBOSBP
SCHEMBL1587344 0.71 AKR1B10 (0.66) PPARGPPARAMAOBAKR1B10AKR1B1
SCHEMBL8017471 0.67 ALOX5 (0.59) PPARGPPARABACE1MAOBOSBP
Geranylgeranylhydroquinone SCHEMBL8025990 0.67 ALOX5 (0.59) PPARGPPARABACE1MAOBOSBP
SCHEMBL31536036 0.67 ALOX5 (0.59) PPARGPPARABACE1MAOBOSBP
SCHEMBL2943955 0.67 ALOX5 (0.59) PPARGPPARABACE1MAOBOSBP

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-2009098287-A1 PHENYL-PRENYL DERIVATIVES, OF MARINE AND SYNTHETIC ORIGIN, FOR THE TREATMENT OF COGNITIVE, NEURODEGENERATIVE OR NEURONAL DISEASES OR DISORDERS NOSCIRA S.A. (ES) 2009-08-13 WO disclosed