SCHEMBL2491489

SCHEMBL2491489

COC(=O)c1cccc(/C=C/c2ccc(OCc3c(-c4c(Cl)cccc4Cl)noc3C(C)C)cc2Cl)c1

nearest known ligand 0.85

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ NR1H4 Q96RI1 20/20 0.85
▸ MEN1 O00255 1/20 0.85
▸ FABP1 P07148 1/20 0.85
▸ THRB P10828 1/20 0.85
▸ LIFR P42702 1/20 0.85
▸ RECQL P46063 1/20 0.85
▸ BLM P54132 1/20 0.85
▸ KMT2A Q03164 1/20 0.85
▸ HSD17B13 Q7Z5P4 1/20 0.85

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
SCHEMBL2491490 1.00 NR1H4 (0.85) NR1H4MEN1FABP1THRBLIFR
SCHEMBL29354246 0.92 NR1H4 (1.00) NR1H4MEN1FABP1THRBLIFR
SCHEMBL3996237 0.92 NR1H4 (1.00) NR1H4MEN1FABP1THRBLIFR
SCHEMBL29459634 0.92 NR1H4 (1.00) NR1H4MEN1FABP1THRBLIFR
SCHEMBL3996233 0.92 NR1H4 (1.00) NR1H4MEN1FABP1THRBLIFR
SCHEMBL14601398 0.87 NR1H4 (0.91) NR1H4MEN1FABP1THRBLIFR
SCHEMBL13805380 0.87 NR1H4 (0.79) NR1H4MEN1FABP1THRBLIFR
SCHEMBL12932245 0.86 NR1H4 (0.81) NR1H4MEN1FABP1THRBLIFR
SCHEMBL21624441 0.86 NR1H4 (1.00) NR1H4LIFR
SCHEMBL16917074 0.86 NR1H4 (0.77) NR1H4MEN1FABP1THRBLIFR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2379081-B1 TREATMENT OF DIARRHOEA ROYAL COLLEGE OF SURGEONS IE (IE) 2013-03-20 — — EP claimed
EP-2379081-A1 TREATMENT OF DIARRHOEA Royal College of Surgeons in Ireland (IE) 2011-10-26 — — EP claimed
US-20110257139-A1 TREATMENT OF DIARRHOEA ROYAL COLLEGE OF SURGEONS IN IRELAND (IE) 2011-10-20 — — US claimed
WO-2010069604-A1 TREATMENT OF DIARRHOEA ROYAL COLLEGE OF SURGEONS IN IRELAND (IE) 2010-06-24 — — WO claimed
EP-1140079-B1 ASSAYS FOR LIGANDS FOR NUCLEAR RECEPTORS GLAXO GROUP LTD (GB) 2009-06-03 — — EP disclosed
US-6984650-B2 Use of FXR ligands SMITHKLINE BEECHAM CORPORATION (US) 2006-01-10 — — US disclosed
EP-1140079-A4 ASSAYS FOR LIGANDS FOR NUCLEAR RECEPTORS GLAXO GROUP LTD (GB) 2004-06-09 — — EP disclosed
US-20040048316-A1 Assays for ligands for nuclear receptors HAFFNER CURT DALE (US) 2004-03-11 — — US disclosed
US-6639078-B1 Assays for ligands for nuclear receptors SMITHKLINE BEECHAM CORPORATION 2003-10-28 — — US disclosed
EP-1140079-A1 ASSAYS FOR LIGANDS FOR NUCLEAR RECEPTORS GLAXO GROUP LIMITED (GB) 2001-10-10 — — EP disclosed
WO-2000037077-A1 ASSAYS FOR LIGANDS FOR NUCLEAR RECEPTORS GLAXO GROUP LIMITED (GB) 2000-06-29 — — WO 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-20040048316-A1 Assays for ligands for nuclear receptors NCOA1, NCOA3, NCOR1 NR1H4 22/4885MEN1 4124/4885FABP1 84/4885

“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.

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