SCHEMBL2065645

SCHEMBL2065645

O=C(O)Cc1cc(Br)cc(Oc2ccc(S(=O)(=O)c3ccccc3)cc2F)c1

nearest known ligand 0.43

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 9/20 0.43
PTGDR2 Q9Y5Y4 7/20 0.42
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
THRA P10827 1/20 0.39
THRB P10828 1/20 0.39
EPAS1 Q99814 1/20 0.38

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
SCHEMBL4205606 0.88 PTGDR2 (0.43) NR3C1PTGDR2MEN1KMT2ATHRA
SCHEMBL883855 0.88 PTGDR2 (0.43) NR3C1PTGDR2MEN1KMT2A
SCHEMBL2065427 0.87 PTGDR2 (0.52) NR3C1PTGDR2EPAS1
SCHEMBL883878 0.87 PTGDR2 (0.44) NR3C1PTGDR2MEN1KMT2A
SCHEMBL2065489 0.85 PTGDR2 (0.41) NR3C1PTGDR2MEN1KMT2AEPAS1
SCHEMBL885395 0.85 THRB (0.41) NR3C1PTGDR2MEN1KMT2ATHRA
SCHEMBL10121257 0.84 PTGDR2 (0.40) NR3C1PTGDR2MEN1KMT2A
SCHEMBL2067780 0.84 PTGDR2 (0.41) NR3C1PTGDR2MEN1KMT2AEPAS1
SCHEMBL883850 0.80 PTGDR2 (0.48) NR3C1PTGDR2EPAS1
SCHEMBL883915 0.79 NR3C1 (0.42) NR3C1PTGDR2THRATHRBEPAS1

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
US-8148572-B2 Compounds ASTRAZENECA AB (SE) 2012-04-03 US claimed
US-20090192163-A1 Novel Compounds ASTRAZENECA AB (SE) 2009-07-30 US claimed
US-8148572-B2 Compounds ASTRAZENECA AB (SE) 2012-04-03 US disclosed
US-8148572-B2 Compounds ASTRAZENECA AB (SE) 2012-04-03 US disclosed
US-8148572-B2 Compounds ASTRAZENECA AB (SE) 2012-04-03 US disclosed
US-20090192163-A1 Novel Compounds ASTRAZENECA AB (SE) 2009-07-30 US disclosed
US-20090192163-A1 Novel Compounds ASTRAZENECA AB (SE) 2009-07-30 US disclosed
US-20090192163-A1 Novel Compounds ASTRAZENECA AB (SE) 2009-07-30 US disclosed
EP-1937632-A1 NOVEL COMPOUNDS Astra Zeneca AB (SE) 2008-07-02 EP disclosed
WO-2007039736-A1 NOVEL COMPOUNDS ASTRAZENECA AB (SE) 2007-04-12 WO disclosed
WO-2007039736-A1 NOVEL COMPOUNDS ASTRAZENECA AB (SE) 2007-04-12 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-20090192163-A1 Novel Compounds PAH, PC, DDC NR3C1 986/4885PTGDR2 1000/4885MEN1 4600/4885

“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.