SCHEMBL6324831

SCHEMBL6324831

CCCCC=C1CCC(=CCC(C)C)C1O

nearest known ligand 0.34

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
NFKB1 P19838 1/20 0.34
NFKB2 Q00653 1/20 0.34
RELA Q04206 1/20 0.34
TYR P14679 1/20 0.31
CCR6 P51684 1/20 0.31
PRKCA P17252 2/20 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
SCHEMBL6325692 0.95 TYR (0.36) NFKB1NFKB2RELATYRPRKCA
SCHEMBL6331105 0.90 PPARG (0.30)
SCHEMBL6327313 0.88 TYR (0.37) NFKB1NFKB2RELATYRCCR6
SCHEMBL6327308 0.88 TYR (0.37) NFKB1NFKB2RELATYRCCR6
SCHEMBL6333734 0.87 TYR (0.31) TYRCCR6
SCHEMBL6323207 0.86
SCHEMBL6325471 0.84 TYR (0.35) TYRCCR6
SCHEMBL6325468 0.84 TYR (0.35) TYRCCR6
SCHEMBL6331667 0.84 TYR (0.41) NFKB1NFKB2RELATYRCCR6
SCHEMBL6331669 0.84 TYR (0.41) NFKB1NFKB2RELATYRCCR6

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-20050009928-A1 Cyclopentanone derivative ZEON CORPORATION (JP) 2005-01-13 US disclosed
EP-1420005-A1 CYCLOPENTANONE DERIVATIVE Zeon Corporation (JP) 2004-05-19 EP 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-20050009928-A1 Cyclopentanone derivative PTGIS, CYP51A1, TRPA1 NFKB1 853/4885NFKB2 897/4885RELA 1502/4885

“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.