SCHEMBL2065744

SCHEMBL2065744

O=C(O)Cc1ccc(Cl)c(Oc2ccc(S(=O)(=O)c3ccccc3)cc2F)c1

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.43
PTGDR2 Q9Y5Y4 7/20 0.42
PTGDR Q13258 4/20 0.42
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
CXCL8 P10145 2/20 0.40
FFAR1 O14842 1/20 0.39
CA5A P35218 1/20 0.39
HTR2A P28223 1/20 0.39
HTR2C P28335 1/20 0.39
CHRM1 P11229 1/20 0.39
SRD5A2 P31213 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
SCHEMBL2066101 0.86 PTGDR2 (0.45) CYP1A2PTGDR2PTGDRCA5A
SCHEMBL883853 0.85 PTGDR2 (0.49) CYP1A2PTGDR2PTGDRCA5A
SCHEMBL883879 0.83 PTGDR2 (0.42) CYP1A2PTGDR2PTGDRCA5A
SCHEMBL2065427 0.81 PTGDR2 (0.52) PTGDR2PTGDR
SCHEMBL883867 0.80 SRD5A2 (0.50) PTGDR2PTGDRCXCL8CHRM1SRD5A2
SCHEMBL4205606 0.78 PTGDR2 (0.43) PTGDR2MEN1KMT2A
SCHEMBL883855 0.78 PTGDR2 (0.43) PTGDR2MEN1KMT2AFFAR1
SCHEMBL2065645 0.77 NR3C1 (0.43) PTGDR2MEN1KMT2A
SCHEMBL883878 0.77 PTGDR2 (0.44) PTGDR2MEN1KMT2A
SCHEMBL586644 0.75 PTGDR2 (0.48) PTGDR2PTGDRCXCL8CA5ACHRM1

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 CYP1A2 84/4885PTGDR2 1000/4885PTGDR 859/4885

“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.