SCHEMBL1754259

SCHEMBL1754259

COC(=O)Cc1ccc(COc2cccc(C3SC(c4ccc(F)cc4)=NN3C(=O)c3ccccc3O)c2OC)cc1

nearest known ligand 0.58

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 19/20 0.58
NR1H3 Q13133 14/20 0.57
RAB9A P51151 1/20 0.41
KMT2A Q03164 1/20 0.41

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
SCHEMBL1754344 0.90 NR1H2 (0.59) NR1H2NR1H3RAB9AKMT2A
SCHEMBL1754655 0.90 NR1H2 (0.59) NR1H2NR1H3RAB9AKMT2A
SCHEMBL1754614 0.89 NR1H2 (0.57) NR1H2NR1H3RAB9AKMT2A
SCHEMBL1753970 0.89 NR1H2 (0.57) NR1H2NR1H3RAB9AKMT2A
SCHEMBL1754333 0.87 NR1H2 (0.59) NR1H2NR1H3
SCHEMBL1754647 0.87 NR1H2 (0.59) NR1H2NR1H3
SCHEMBL1754117 0.87 NR1H2 (0.73) NR1H2NR1H3
SCHEMBL1753979 0.86 NR1H2 (0.59) NR1H2NR1H3
SCHEMBL1754700 0.86 NR1H2 (0.59) NR1H2NR1H3KMT2A
SCHEMBL1754689 0.86 NR1H2 (0.59) NR1H2NR1H3KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8569345-B2 Compounds and compositions as LXR modulators MOLTENI VALENTINA (US) 2013-10-29 US disclosed
US-8569345-B2 Compounds and compositions as LXR modulators MOLTENI VALENTINA (US) 2013-10-29 US disclosed
US-20120214812-A1 COMPOUNDS AND COMPOSITIONS AS LXR MODULATORS IRM LLC (BM) 2012-08-23 US disclosed
US-20120214812-A1 COMPOUNDS AND COMPOSITIONS AS LXR MODULATORS IRM LLC (BM) 2012-08-23 US disclosed
US-8158662-B2 Compounds and compositions as LXR modulators HAMILTON (BM) 2012-04-17 US disclosed
US-8158662-B2 Compounds and compositions as LXR modulators HAMILTON (BM) 2012-04-17 US disclosed
US-20090325981-A1 Compounds and compositions as lxr modulators IRM LLC (BM) 2009-12-31 US disclosed
US-20090325981-A1 Compounds and compositions as lxr modulators IRM LLC (BM) 2009-12-31 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 (2 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-20090325981-A1 Compounds and compositions as lxr modulators NR1H2, NR1H3, NR1H4 NR1H2 1/4885NR1H3 2/4885RAB9A 2722/4885
US-20120214812-A1 COMPOUNDS AND COMPOSITIONS AS LXR MODULATORS NR1H2, NR1H3, NR1H4 NR1H2 1/4885NR1H3 2/4885RAB9A 2722/4885

“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.