SCHEMBL15970330

SCHEMBL15970330

CC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCc1cc(C)c(O)c(O)c1C

nearest known ligand 0.59

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAOB P27338 7/20 0.59
APP P05067 5/20 0.59
BACE1 P56817 3/20 0.58
PTPN1 P18031 2/20 0.56
OSBP P22059 1/20 0.50
KMT2A Q03164 1/20 0.47
PTGES O14684 1/20 0.47
ALOX5 P09917 1/20 0.47
PTGS1 P23219 1/20 0.47
PTGS2 P35354 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
SCHEMBL15970329 1.00 MAOB (0.59) MAOBAPPBACE1PTPN1OSBP
SCHEMBL15970283 0.90 MAOB (0.58) MAOBAPPBACE1PTPN1OSBP
SCHEMBL15970285 0.90 MAOB (0.58) MAOBAPPBACE1PTPN1OSBP
SCHEMBL4614966 0.84 BACE1 (0.79) MAOBAPPBACE1PTPN1OSBP
SCHEMBL29352109 0.84 BACE1 (0.79) MAOBAPPBACE1PTPN1OSBP
SCHEMBL15970619 0.84 MAOB (0.62) MAOBAPPBACE1PTPN1OSBP
SCHEMBL15970620 0.84 MAOB (0.62) MAOBAPPBACE1PTPN1OSBP
SCHEMBL4807578 0.84 BACE1 (0.79) MAOBAPPBACE1PTPN1OSBP
SCHEMBL9241176 0.81 MAOB (0.66) MAOBAPPBACE1PTPN1OSBP
SCHEMBL14248455 0.81 BACE1 (0.55) MAOBAPPBACE1PTPN1OSBP

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.