SCHEMBL15970581

SCHEMBL15970581

CC(C)=CCC/C(C)=C/CC/C(C)=C/Cc1ccc(C)c(O)c1O

nearest known ligand 0.57

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAOB P27338 5/20 0.57
APP P05067 5/20 0.57
BACE1 P56817 3/20 0.54
PTPN1 P18031 2/20 0.54
KMT2A Q03164 1/20 0.48
ACHE P22303 1/20 0.48
OSBP P22059 1/20 0.48
VKORC1 Q9BQB6 1/20 0.47
PGR P06401 1/20 0.47
HTR1A P08908 1/20 0.47
ADORA3 P0DMS8 1/20 0.47
MAPT P10636 1/20 0.47
PTGS1 P23219 1/20 0.47
PDE4A P27815 1/20 0.47
MAPK1 P28482 1/20 0.47
DRD3 P35462 1/20 0.47
SNCA P37840 1/20 0.47
PDE3A Q14432 1/20 0.47

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
SCHEMBL14248332 1.00 MAOB (0.57) MAOBAPPBACE1PTPN1KMT2A
SCHEMBL8850727 0.86 MAOB (0.54) MAOBAPPBACE1PTPN1ACHE
SCHEMBL8850717 0.86 MAOB (0.54) MAOBAPPBACE1PTPN1ACHE
SCHEMBL8997133 0.82 ACHE (0.54) MAOBAPPBACE1PTPN1KMT2A
SCHEMBL8997136 0.82 ACHE (0.54) MAOBAPPBACE1PTPN1KMT2A
SCHEMBL14248455 0.82 BACE1 (0.55) MAOBAPPBACE1PTPN1ACHE
SCHEMBL15970615 0.82 BACE1 (0.55) MAOBAPPBACE1PTPN1ACHE
SCHEMBL15970285 0.82 MAOB (0.58) MAOBAPPBACE1PTPN1KMT2A
SCHEMBL15970283 0.82 MAOB (0.58) MAOBAPPBACE1PTPN1KMT2A
SCHEMBL30392737 0.81 BACE1 (0.51) MAOBAPPBACE1PTPN1KMT2A

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-9464016-B2 Catechol derivatives for treatment of oxidative stress diseases EDISON PHARMACEUTICALS, INC. (US) 2016-10-11 US disclosed
US-20140243424-A1 CATECHOL DERIVATIVES FOR TREATMENT OF OXIDATIVE STRESS DISEASES EDISON PHARMACEUTICALS, INC. (US) 2014-08-28 US 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-20140243424-A1 CATECHOL DERIVATIVES FOR TREATMENT OF OXIDATIVE STRESS DISEASES OPA1, PC, PCK2 MAOB 209/4885APP 638/4885BACE1 769/4885

“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.