SCHEMBL8027423

SCHEMBL8027423

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

nearest known ligand 0.67

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 5/20 0.67
HTT P42858 2/20 0.43
MAPKAPK2 P49137 1/20 0.42
MAOB P27338 2/20 0.42
APP P05067 2/20 0.41
ALDH1A1 P00352 1/20 0.41
HPGD P15428 1/20 0.41
PTPN1 P18031 4/20 0.40
DHODH Q02127 1/20 0.39
CNR2 P34972 1/20 0.38
ALOX5 P09917 1/20 0.38
ALOX15 P16050 1/20 0.38
SLC6A3 Q01959 1/20 0.37
TRPM7 Q96QT4 1/20 0.37
DAGLA Q9Y4D2 1/20 0.37

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 0.84 BACE1 (0.46) BACE1MAOBAPPPTPN1DHODH
SCHEMBL8021149 0.84 PPARG (0.47) BACE1MAOBPTPN1DHODHALOX5
SCHEMBL1587245 0.83 BACE1 (0.81) BACE1HTTMAPKAPK2MAOBAPP
SCHEMBL1586724 0.83 BACE1 (0.81) BACE1HTTMAPKAPK2MAOBAPP
SCHEMBL30392401 0.83 BACE1 (0.81) BACE1HTTMAPKAPK2MAOBAPP
SCHEMBL1586722 0.83 BACE1 (0.81) BACE1HTTMAPKAPK2MAOBAPP
SCHEMBL8009478 0.83 BACE1 (0.81) BACE1HTTMAPKAPK2MAOBAPP
SCHEMBL8011241 0.81 BACE1 (0.79) BACE1HTTMAPKAPK2MAOBAPP
SCHEMBL27660353 0.74 BACE1 (0.63) BACE1HTTMAOBAPPALDH1A1
SCHEMBL28456337 0.74 BACE1 (0.66) BACE1HTTMAPKAPK2ALDH1A1HPGD

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
US-20110092591-A1 PHENYL-PRENYL DERIVATIVES, OF MARINE AND SYNTHETIC ORIGIN, FOR THE TREATMENT OF COGNITIVE, NEURODEGENERATIVE OR NEURONAL DISEASES OR DISORDERS NOSCIRA S.A. (ES) 2011-04-21 US disclosed
US-20110092591-A1 PHENYL-PRENYL DERIVATIVES, OF MARINE AND SYNTHETIC ORIGIN, FOR THE TREATMENT OF COGNITIVE, NEURODEGENERATIVE OR NEURONAL DISEASES OR DISORDERS NOSCIRA S.A. (ES) 2011-04-21 US disclosed
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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110092591-A1 PHENYL-PRENYL DERIVATIVES, OF MARINE AND SYNTHETIC ORIGIN, FOR THE TREATMENT OF COGNITIVE, NEURODEGENERATIVE OR NEURONAL DISEASES OR DISORDERS PSEN1, PARK7, APP BACE1 8/4885HTT 50/4885MAPKAPK2 680/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.