SCHEMBL5425639

SCHEMBL5425639

O=C(O)/C=C/c1ccc(Cl)cc1-c1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGER3 P43115 3/20 0.56
PTGER2 P43116 3/20 0.56
PTGER1 P34995 2/20 0.56
MDM2 Q00987 1/20 0.53
ITGB2 P05107 1/20 0.52
ICAM1 P05362 1/20 0.52
ITGAL P20701 1/20 0.52
TBXA2R P21731 1/20 0.52
PTGFR P43088 1/20 0.52
PTGIR P43119 1/20 0.52
PTGDR Q13258 1/20 0.52
PLA2G1B P04054 1/20 0.52
MAPT P10636 1/20 0.52
ATG4B Q9Y4P1 1/20 0.52
LMNA P02545 1/20 0.49
HDAC8 Q9BY41 4/20 0.47
PTGDR2 Q9Y5Y4 1/20 0.47
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
NFKB1 P19838 1/20 0.46

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
SCHEMBL5425644 1.00 PTGER3 (0.56) PTGER3PTGER2PTGER1MDM2ITGB2
SCHEMBL3292938 0.87 PTGER3 (0.56) PTGER3PTGER2PTGER1MDM2ITGB2
SCHEMBL3292939 0.87 PTGER3 (0.56) PTGER3PTGER2PTGER1MDM2ITGB2
SCHEMBL24089528 0.87 PTGER3 (0.50) PTGER3PTGER2PTGER1MDM2ITGB2
SCHEMBL27969144 0.86 MAOB (0.56) MAPTLMNAARPKM
SCHEMBL17802340 0.83 PTGER1 (0.55) PTGER3PTGER2PTGER1MAPTLMNA
SCHEMBL2467808 0.82 PELI1 (0.62) PTGER3PTGER2PTGER1HDAC8CA1
SCHEMBL2467811 0.82 PELI1 (0.62) PTGER3PTGER2PTGER1HDAC8CA1
SCHEMBL1225003 0.81 PTGER3 (0.69) PTGER3PTGER2PTGER1MDM2ITGB2
SCHEMBL28198810 0.81 HDAC8 (0.50) PTGER3PTGER2PTGER1HDAC8PTGDR2

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-20070249686-A1 Modulators of Crth-2 Receptor Activity for the Treatment of Prostaglandin D2 Mediated Diseases ASTRAZENECA AB (SE) 2007-10-25 US claimed
EP-1799658-A2 MODULATORS OF CRTH2 REZEPTOR ACTIVITY FOR THE TREATMENT OF PROSTAGLANDIN D2 MEDIATED DISEASES AstraZeneca AB (SE) 2007-06-27 EP claimed
WO-2006037982-A2 MODULATORS OF CRTH2 RECEPTOR ACTIVITY FOR THE TREATMENT OF PROSTAGLANDIN D2 MEDIATED DISEASES ASTRAZENECA AB (SE) 2006-04-13 WO claimed
US-20070249686-A1 Modulators of Crth-2 Receptor Activity for the Treatment of Prostaglandin D2 Mediated Diseases ASTRAZENECA AB (SE) 2007-10-25 US disclosed
US-20070249686-A1 Modulators of Crth-2 Receptor Activity for the Treatment of Prostaglandin D2 Mediated Diseases ASTRAZENECA AB (SE) 2007-10-25 US disclosed
US-20070249686-A1 Modulators of Crth-2 Receptor Activity for the Treatment of Prostaglandin D2 Mediated Diseases ASTRAZENECA AB (SE) 2007-10-25 US disclosed
EP-1799658-A2 MODULATORS OF CRTH2 REZEPTOR ACTIVITY FOR THE TREATMENT OF PROSTAGLANDIN D2 MEDIATED DISEASES AstraZeneca AB (SE) 2007-06-27 EP disclosed
WO-2006037982-A2 MODULATORS OF CRTH2 RECEPTOR ACTIVITY FOR THE TREATMENT OF PROSTAGLANDIN D2 MEDIATED DISEASES ASTRAZENECA AB (SE) 2006-04-13 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-20070249686-A1 Modulators of Crth-2 Receptor Activity for the Treatment of Prostaglandin D2 Mediated Diseases PTGDR2, PTGDR, PTGER2 PTGER3 14/4885PTGER2 3/4885PTGER1 5/4885

“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.