SCHEMBL13087005

SCHEMBL13087005

NOc1cc(O)cc2c(Br)cn(-c3ccc(O)cc3)c(=O)c12

nearest known ligand 0.70

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 17/20 0.70
ESR1 P03372 13/20 0.70
ESRRA P11474 10/20 0.70

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
SCHEMBL2586208 0.82 ESR2 (1.00) ESR2ESR1ESRRA
SCHEMBL3060396 0.81 ESR2 (0.81) ESR2ESR1ESRRA
SCHEMBL14138429 0.80 ESR2 (0.75) ESR2ESR1ESRRA
SCHEMBL13097499 0.78 ESR2 (0.71) ESR2ESR1ESRRA
SCHEMBL2591035 0.78 ESR2 (0.71) ESR2ESR1ESRRA
SCHEMBL2592071 0.78 ESR2 (1.00) ESR2ESR1ESRRA
SCHEMBL13969816 0.78 ESR2 (0.71) ESR2ESR1ESRRA
SCHEMBL13087226 0.78 ESR2 (0.66) ESR2ESR1ESRRA
SCHEMBL18381906 0.77 ESR2 (0.79) ESR2ESR1ESRRA
SCHEMBL13948737 0.77 ESR2 (0.79) ESR2ESR1ESRRA

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-9623021-B2 Nuclear receptor binding agents GTX, INC. (US) 2017-04-18 US disclosed
US-20100267767-A1 NUCLEAR RECEPTOR BINDING AGENTS GTX, INC. 2010-10-21 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-20100267767-A1 NUCLEAR RECEPTOR BINDING AGENTS FABP1, FABP4, ADIPOR2 ESR2 16/4885ESR1 145/4885ESRRA 11/4885

“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.