SCHEMBL6326545

SCHEMBL6326545

CCC(C)C1CCC(C2CCCCC2)C1O

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SHBG P04278 1/20 0.33
KDM4E B2RXH2 1/20 0.31
TSHR P16473 1/20 0.31
HSD17B10 Q99714 1/20 0.31
EPHX1 P07099 1/20 0.31

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
SCHEMBL6634333 0.98 KDM4E (0.32) SHBGKDM4ETSHRHSD17B10
SCHEMBL6324600 0.80 TSHR (0.38) SHBGKDM4ETSHRHSD17B10
SCHEMBL2307844 0.76 GBA1 (0.34) SHBGKDM4ETSHRHSD17B10
SCHEMBL4844949 0.74 CA1 (0.40) SHBGKDM4ETSHRHSD17B10EPHX1
SCHEMBL4847122 0.74 CA1 (0.40) SHBGKDM4ETSHRHSD17B10EPHX1
SCHEMBL5548503 0.72 CYP1A2 (0.34) SHBGKDM4ETSHRHSD17B10
SCHEMBL6331251 0.72 ALDH1A1 (0.41) KDM4ETSHR
SCHEMBL6328019 0.72 ALDH1A1 (0.41) KDM4ETSHR
SCHEMBL2992837 0.72 SHBG (0.30) SHBG
SCHEMBL18595189 0.71 CA1 (0.41) SHBGKDM4ETSHRHSD17B10EPHX1

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 SHBG 3139/4885KDM4E 2486/4885TSHR 4837/4885

“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.