SCHEMBL351687

SCHEMBL351687

Cc1ncc(C(=O)NC2=CC(=O)C3OC3C2O)c(O)n1

nearest known ligand 0.48

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PARK7 Q99497 1/20 0.48
GRM5 P41594 1/20 0.31
JUN P05412 1/20 0.30
NFKB1 P19838 1/20 0.30
NFKB2 Q00653 1/20 0.30
RELA Q04206 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
SCHEMBL16650230 0.81 PARK7 (0.42) PARK7
SCHEMBL353155 0.77 PARK7 (0.48) PARK7JUNNFKB1NFKB2RELA
SCHEMBL352102 0.76 PARK7 (0.47) PARK7
SCHEMBL352808 0.75 PARK7 (0.46) PARK7
SCHEMBL115782 0.75 PARK7 (0.51) PARK7
SCHEMBL351849 0.75 PARK7 (0.45) PARK7
Dehydroxymethylepoxyquinomicin SCHEMBL1671089 0.74 PARK7 (0.54) PARK7NFKB1NFKB2RELA
SCHEMBL353742 0.73 PARK7 (0.54) PARK7NFKB1NFKB2RELA
SCHEMBL666087 0.73 PARK7 (0.64) PARK7
SCHEMBL352443 0.72 PARK7 (0.43) PARK7

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-20120015952-A1 Inhibitors of NF-KB PROFECTUS BIOSCIENCES, INC. (US) 2012-01-19 US claimed
US-20120015952-A1 Inhibitors of NF-KB PROFECTUS BIOSCIENCES, INC. (US) 2012-01-19 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-20120015952-A1 Inhibitors of NF-KB NFKBIA, IKBKB, IKBKG PARK7 3327/4885GRM5 4441/4885JUN 44/4885

“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.