SCHEMBL8027765

SCHEMBL8027765

CCCCOc1ccc(C(=O)O)cc1C/C=C(\C)CC/C=C(\C)CCC=C(C)C

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 2/20 0.54
PLA2G2D Q9UNK4 1/20 0.48
LTB4R Q15722 1/20 0.47
SLC6A3 Q01959 1/20 0.46
TRPM7 Q96QT4 1/20 0.46
DAGLA Q9Y4D2 1/20 0.46
ALDH1A1 P00352 1/20 0.44
HPGD P15428 1/20 0.44
PTPN11 Q06124 1/20 0.43
MAOB P27338 1/20 0.42
CNR1 P21554 1/20 0.42
CNR2 P34972 1/20 0.42
TRPV1 Q8NER1 1/20 0.42
TP53 P04637 1/20 0.42
TSHR P16473 1/20 0.42

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
SCHEMBL8023186 0.99 BACE1 (0.52) BACE1PLA2G2DLTB4RSLC6A3TRPM7
SCHEMBL8011278 0.86 BACE1 (0.55) BACE1MAOBTSHR
SCHEMBL8026218 0.85 ALDH1A1 (0.43) BACE1ALDH1A1CNR1CNR2TRPV1
SCHEMBL8009534 0.84 BACE1 (0.53) BACE1MAOBTRPV1TSHR
SCHEMBL8019435 0.84 BACE1 (0.58) BACE1ALDH1A1MAOBTSHR
SCHEMBL8010389 0.84 BACE1 (0.53) BACE1CNR2TRPV1
SCHEMBL8026637 0.83 PPARG (0.47) SLC6A3TRPM7DAGLAALDH1A1HPGD
SCHEMBL12702676 0.83 BACE1 (0.56) BACE1ALDH1A1MAOBTRPV1TSHR
SCHEMBL5590799 0.83 BACE1 (0.56) BACE1MAOBTSHR
SCHEMBL8020241 0.83 BACE1 (0.51) BACE1CNR2TRPV1

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 2 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
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 8/4885PLA2G2D 270/4885LTB4R 1829/4885

“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.