SCHEMBL2945003

SCHEMBL2945003

CC(Oc1ccc(Cl)cc1Cc1cc(Cl)ccc1OCC(=O)OCc1ccccc1)C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PTGER1 P34995 15/20 0.47
TSHR P16473 1/20 0.47
HTR2A P28223 1/20 0.47
HTR2C P28335 1/20 0.47
HTR2B P41595 1/20 0.47
PTGDR2 Q9Y5Y4 2/20 0.46
MASP2 O00187 1/20 0.45
F2 P00734 1/20 0.45

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
SCHEMBL2944319 0.89 PTGER1 (0.45) PTGER1MASP2F2
SCHEMBL2944068 0.87 LMNA (0.49) PTGER1TSHRPTGDR2MASP2F2
SCHEMBL4656398 0.86 PTGER1 (0.52) PTGER1PTGDR2MASP2F2
SCHEMBL2946766 0.86 MAPT (0.58) PTGER1TSHRPTGDR2F2
SCHEMBL2945768 0.84 TSHR (0.48) PTGER1TSHRHTR2AHTR2CHTR2B
SCHEMBL2941158 0.84 MEN1 (0.53) PTGER1F2
SCHEMBL1332738 0.83 TSHR (0.59) PTGER1TSHRHTR2AHTR2CHTR2B
SCHEMBL4910758 0.83 PTGER1 (0.49) PTGER1
SCHEMBL13603780 0.82 TSHR (0.68) PTGER1TSHRHTR2AHTR2CHTR2B
SCHEMBL4626196 0.80 MAPT (0.55) PTGER1MASP2F2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7678826-B2 Organic compounds for the treatment of inflammatory or allergic conditions NOVARTIS AG (CH) 2010-03-16 US disclosed
EP-1891029-B1 ORGANIC COMPOUNDS FOR THE TREATMENT OF IMFLAMMATORY OR ALLERIC CONDITIONS NOVARTIS AG (CH) 2010-01-06 EP disclosed
US-20080200466-A1 Organic Compounds For the Treatment of Inflammatory or Allergic Conditions NOVARTIS AG (CH) 2008-08-21 US disclosed
EP-1891029-A1 ORGANIC COMPOUNDS FOR THE TREATMENT OF IMFLAMMATORY OR ALLERIC CONDITIONS Novartis AG (CH) 2008-02-27 EP disclosed
WO-2006125596-A1 ORGANIC COMPOUNDS FOR THE TREATMENT OF IMFLAMMATORY OR ALLERIC CONDITIONS NOVARTIS AG (CH) 2006-11-30 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-20080200466-A1 Organic Compounds For the Treatment of Inflammatory or Allergic Conditions HRH2, MRGPRX2, HRH1 PTGER1 44/4885TSHR 450/4885HTR2A 936/4885

“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.