SCHEMBL23965813

SCHEMBL23965813

CC(C)(C)[Si](C)(C)Oc1c(-c2ccc(OCc3ccccc3)c(OCc3ccccc3)c2)oc2cc(OCc3ccccc3)cc(OCc3ccccc3)c2c1=O

nearest known ligand 0.55

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PPARG P37231 1/20 0.54
ELANE P08246 5/20 0.51
PLG P00747 3/20 0.51
ADORA3 P0DMS8 2/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
ACE2 Q9BYF1 2/20 0.49

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
SCHEMBL23965831 0.93 ACE2 (0.59) PPARGPLGADORA3L3MBTL1ACE2
SCHEMBL17358237 0.91 PPARG (0.47) PPARGELANEPLGADORA3ACE2
Benzquercin SCHEMBL1057326 0.88 PPARG (0.66) PPARGELANEPLGADORA3L3MBTL1
SCHEMBL20630735 0.86 ADORA3 (0.69) PPARGELANEPLGADORA3L3MBTL1
SCHEMBL31236659 0.86 ADORA3 (0.69) PPARGELANEPLGADORA3L3MBTL1
SCHEMBL17358238 0.85 ACE2 (0.52) PPARGADORA3ACE2
SCHEMBL7545480 0.84 PPARG (0.70) PPARGELANEPLGADORA3L3MBTL1
SCHEMBL20631423 0.82 ADORA3 (0.61) PPARGELANEPLGADORA3L3MBTL1
SCHEMBL20631309 0.82 ADORA3 (0.61) PPARGELANEPLGADORA3L3MBTL1
SCHEMBL31236661 0.82 ADORA3 (0.61) PPARGELANEPLGADORA3L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2948437-B1 APPROACH FOR SYNTHESIS OF CATECHINS EPIRIUM BIO INC (US) 2021-11-03 EP disclosed