SCHEMBL2592071

SCHEMBL2592071

O=C(O)c1cc(O)cc2c(Br)cn(-c3ccc(O)cc3)c(=O)c12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 15/20 1.00
ESR1 P03372 14/20 1.00
ESRRA P11474 9/20 0.71
KDM4E B2RXH2 2/20 0.40
CAPN1 P07384 1/20 0.40
LMNA P02545 1/20 0.39

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
SCHEMBL3060396 0.90 ESR2 (0.81) ESR2ESR1ESRRACAPN1
SCHEMBL13097500 0.89 ESR2 (0.80) ESR2ESR1ESRRAKDM4ECAPN1
SCHEMBL18381906 0.88 ESR2 (0.79) ESR2ESR1ESRRA
SCHEMBL13948737 0.88 ESR2 (0.79) ESR2ESR1ESRRAKDM4E
SCHEMBL13087050 0.88 ESR2 (0.79) ESR2ESR1ESRRAKDM4E
SCHEMBL2588634 0.85 ESR2 (0.74) ESR2ESR1ESRRAKDM4ELMNA
SCHEMBL14138473 0.84 ESR1 (0.73) ESR2ESR1ESRRAKDM4ECAPN1
SCHEMBL2586208 0.83 ESR2 (1.00) ESR2ESR1ESRRA
SCHEMBL14138429 0.81 ESR2 (0.75) ESR2ESR1ESRRA
SCHEMBL13097499 0.79 ESR2 (0.71) 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 38 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170014401-A1 NUCLEAR RECEPTOR BINDING AGENTS GTX, INC. 2017-01-19 US claimed
EP-2647376-A1 Nuclear receptor binding agents Gtx, Inc. (US) 2013-10-09 EP claimed
CN-101641013-A Nuclear receptor binding agents GTX INC US 2010-02-03 CN claimed
EP-2106212-A2 NUCLEAR RECEPTOR BINDING AGENTS GTX, Inc. (US) 2009-10-07 EP claimed
US-20090030036-A1 Nuclear receptor binding agents GTX, INC. 2009-01-29 US claimed
WO-2008091555-A2 NUCLEAR RECEPTOR BINDING AGENTS GTX, INC. (US) 2008-07-31 WO claimed
US-9623021-B2 Nuclear receptor binding agents GTX, INC. (US) 2017-04-18 US disclosed
US-9623021-B2 Nuclear receptor binding agents GTX, INC. (US) 2017-04-18 US disclosed
US-9623021-B2 Nuclear receptor binding agents GTX, INC. (US) 2017-04-18 US disclosed
US-9604931-B2 Nuclear receptor binding agents GTX, INC. (US) 2017-03-28 US disclosed
US-9604931-B2 Nuclear receptor binding agents GTX, INC. (US) 2017-03-28 US disclosed
US-9604931-B2 Nuclear receptor binding agents GTX, INC. (US) 2017-03-28 US disclosed
CN-106420745-A Application of nuclear receptor binding agents in preparation of drugs for treating obesity, fibrosis, and cardiovascular diseases GTX公司 2017-02-22 CN disclosed
US-20100267767-A1 NUCLEAR RECEPTOR BINDING AGENTS GTX, INC. 2010-10-21 US disclosed
US-20100267767-A1 NUCLEAR RECEPTOR BINDING AGENTS GTX, INC. 2010-10-21 US disclosed
US-20100267767-A1 NUCLEAR RECEPTOR BINDING AGENTS GTX, INC. 2010-10-21 US disclosed
CN-101641013-A Nuclear receptor binding agents GTX INC US 2010-02-03 CN disclosed
US-20090030036-A1 Nuclear receptor binding agents GTX, INC. 2009-01-29 US disclosed
US-20090030036-A1 Nuclear receptor binding agents GTX, INC. 2009-01-29 US disclosed
US-20090030036-A1 Nuclear receptor binding agents GTX, INC. 2009-01-29 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 (3 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-20170014401-A1 NUCLEAR RECEPTOR BINDING AGENTS ESRRB, ESRRG, ESRRA ESR2 4/4885ESR1 28/4885ESRRA 3/4885
US-20090030036-A1 Nuclear receptor binding agents NR0B1, NR2E3, NR0B2 ESR2 22/4885ESR1 63/4885ESRRA 4/4885
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.