SCHEMBL3452272

SCHEMBL3452272

COc1cc(C(C)(C)c2ccc(C(C)(c3cc(OC)c(O)c(C(c4cc(C)c(O)cc4C)c4cc(C)c(O)cc4C)c3)c3cc(OC)c(O)c(C(c4cc(C)c(O)cc4C)c4cc(C)c(O)cc4C)c3)cc2)cc(C(c2cc(C)c(O)cc2C)c2cc(C)c(O)cc2C)c1O

nearest known ligand 0.38

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 2/20 0.37
ESR2 Q92731 1/20 0.36
RORC P51449 1/20 0.32
ALOX15 P16050 1/20 0.30
ALOX12 P18054 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
SCHEMBL3452403 0.88 ESR1 (0.42) ESR1ESR2RORCALOX15ALOX12
SCHEMBL3451706 0.84 ESR1 (0.40) ESR1ESR2RORCALOX15ALOX12
SCHEMBL3452257 0.82 ELANE (0.36) ESR1ESR2ALOX15
SCHEMBL3451604 0.81 ESR1 (0.40) ESR1ESR2RORCALOX15ALOX12
SCHEMBL3450671 0.77 ESR1 (0.33) ESR1ESR2
SCHEMBL3452242 0.77 BCHE (0.41) ESR1ESR2RORC
SCHEMBL13400794 0.76 ESR1 (0.35) ESR1ESR2RORC
SCHEMBL2192012 0.75 THRA (0.38) ESR1ESR2RORC
SCHEMBL12258191 0.75 ESR1 (0.33) ESR1ESR2RORC
SCHEMBL3452865 0.74 ESR1 (0.37) ESR1ESR2RORCALOX15ALOX12

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-7858819-B2 Tris(formylphenyl) and novel polynuclear phenol derived therefrom HONSHU CHEMICAL INDUSTRY CO., LTD. (JP) 2010-12-28 US disclosed
US-20100099908-A1 TRIS(FORMYLPHENYL) AND NEW POLYNUCLEAR POLYPHENOL DERIVED THEREFROM HONSHU CHEMICAL INDUSTRY CO., LTD. (JP) 2010-04-22 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-20100099908-A1 TRIS(FORMYLPHENYL) AND NEW POLYNUCLEAR POLYPHENOL DERIVED THEREFROM AS3MT, RRM2, SHROOM3 ESR1 132/4885ESR2 382/4885RORC 466/4885

“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.