SCHEMBL546779

SCHEMBL546779

Cc1cc2c(cc1B1OC(C)(C)C(C)(C)O1)C(C)(C)c1cc(-c3ccc4c(c3)C(C)(C)c3ccccc3-4)c(C)cc1-2

nearest known ligand 0.36

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 4/20 0.36
LPL P06858 2/20 0.35
LIPG Q9Y5X9 2/20 0.35

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
SCHEMBL22990066 0.84 LIPG (0.48) PDK2LPLLIPG
SCHEMBL21995628 0.83 LPL (0.41) PDK2LPLLIPG
SCHEMBL23486069 0.81 LPL (0.37) LPLLIPG
SCHEMBL547004 0.80 MAPK1 (0.33) LPLLIPG
SCHEMBL29738313 0.80 LPL (0.38) PDK2LPLLIPG
SCHEMBL12442308 0.80 LPL (0.38) PDK2LPLLIPG
SCHEMBL12860031 0.80 LPL (0.34) PDK2LPLLIPG
SCHEMBL546793 0.80 SNCA (0.36) LPLLIPG
SCHEMBL17142003 0.79 LPL (0.37) PDK2LPLLIPG
SCHEMBL17142015 0.79 LPL (0.44) PDK2LPLLIPG

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-8110294-B2 Fluorene compound; steric hindrance CANON KABUSHIKI KAISHA (JP) 2012-02-07 US disclosed
US-20080200736-A1 MATERIAL FOR ORGANIC LIGHT-EMITTING ELEMENT AND ORGANIC LIGHT-EMITTING ELEMENT INCLUDING THE SAME CANON KABUSHIKI KAISHA (JP) 2008-08-21 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-20080200736-A1 MATERIAL FOR ORGANIC LIGHT-EMITTING ELEMENT AND ORGANIC LIGHT-EMITTING ELEMENT INCLUDING THE SAME LEF1, FMNL1, AFF1 PDK2 3787/4885LPL 1829/4885LIPG 1955/4885

“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.