SCHEMBL6093340

SCHEMBL6093340

Cc1ccc2c(C3=C(O)C(=O)C=C(O)C3=O)c[nH]c2c1C

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
XIAP P98170 1/20 0.33
CSNK2A2 P19784 1/20 0.32
CSNK2B P67870 1/20 0.32
CSNK2A1 P68400 1/20 0.32
DAO P14920 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
SCHEMBL6098001 0.84 BRPF1 (0.43)
SCHEMBL6096646 0.79 CSNK2A2 (0.44) XIAPCSNK2A2CSNK2BCSNK2A1
SCHEMBL6095891 0.77 AR (0.34) XIAPDAO
SCHEMBL6096598 0.76 AR (0.41) DAO
SCHEMBL6096362 0.76 GPR84 (0.40)
SCHEMBL6095132 0.76 CLK1 (0.40) XIAP
SCHEMBL6094665 0.76 NR4A2 (0.41) XIAP
SCHEMBL6095610 0.76 ALDH1A1 (0.47)
SCHEMBL6095551 0.74 XIAP (0.38) XIAPDAO
SCHEMBL6099160 0.74 CSNK2A2 (0.34) CSNK2A2CSNK2BCSNK2A1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7057052-B2 Heterocyclic quinones as pharmaceutical agents DUKE UNIVERSITY (US) 2006-06-06 US disclosed
WO-2004050014-A2 SETEROCYCLIC QUINONES AS PHARMACEUTICAL AGENTS DUKE UNIVERSITY (US) 2004-06-17 WO disclosed
US-20040063774-A1 Heterocyclic quinones as pharmaceutical agents DUKE UNIVERSITY 2004-04-01 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-20040063774-A1 Heterocyclic quinones as pharmaceutical agents NQO1, RECQL, SDHA XIAP 620/4885CSNK2A2 3333/4885CSNK2B 3574/4885

“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.