SCHEMBL663095

SCHEMBL663095

O=C(NC1=CC(=O)C2OC2C1O)c1c(Cl)ccc(Cl)c1O

nearest known ligand 0.44

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PARK7 Q99497 1/20 0.44
DPP4 P27487 1/20 0.36
JAK2 O60674 2/20 0.31
JAK1 P23458 2/20 0.31
TYK2 P29597 2/20 0.31
CYP3A4 P08684 1/20 0.31
RAB9A P51151 1/20 0.30

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
SCHEMBL666932 0.85 HSPA5 (0.46) PARK7
SCHEMBL665288 0.84 PARK7 (0.53) PARK7
SCHEMBL665474 0.78 PARK7 (0.49) PARK7RAB9A
SCHEMBL665039 0.76 PARK7 (0.50) PARK7RAB9A
Dehydroxymethylepoxyquinomicin SCHEMBL1671089 0.75 PARK7 (0.54) PARK7RAB9A
Dehydroxymethylepoxyquinomicin SCHEMBL1669417 0.75 PARK7 (0.54) PARK7RAB9A
Dehydroxymethylepoxyquinomicin SCHEMBL14491796 0.75 PARK7 (0.54) PARK7RAB9A
Dehydroxymethylepoxyquinomicin SCHEMBL14504317 0.75 PARK7 (0.54) PARK7RAB9A
SCHEMBL115782 0.74 PARK7 (0.51) PARK7CYP3A4RAB9A
SCHEMBL665471 0.72 PARK7 (0.57) PARK7RAB9A

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-20120046357-A1 Benzamide and Napthamide Derivatives Inhibiting Nuclear Factor-Kappa (B) - (NK-kB) PROFECTUS BIOSCIENCES, INC. (US) 2012-02-23 US claimed
US-20120046357-A1 Benzamide and Napthamide Derivatives Inhibiting Nuclear Factor-Kappa (B) - (NK-kB) PROFECTUS BIOSCIENCES, INC. (US) 2012-02-23 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-20120046357-A1 Benzamide and Napthamide Derivatives Inhibiting Nuclear Factor-Kappa (B) - (NK-kB) NFKBIA, IKBKB, NFKB1 PARK7 3384/4885DPP4 1016/4885JAK2 1845/4885

“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.