SCHEMBL1713851

SCHEMBL1713851

C[C@H]1CN(c2cc(CC(F)(F)F)ccc2OCC(=O)O)CCN1C(=O)Cc1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ PTGDR2 Q9Y5Y4 12/20 0.55
▸ LIMK2 P53671 1/20 0.43
▸ CXCR3 P49682 2/20 0.39
▸ PANK3 Q9H999 2/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ CHRM4 P08173 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
SCHEMBL13800297 0.88 PTGDR2 (0.63) PTGDR2LIMK2CXCR3
SCHEMBL13800295 0.86 PTGDR2 (0.59) PTGDR2LIMK2
SCHEMBL13800256 0.85 PTGDR2 (0.71) PTGDR2LIMK2
SCHEMBL13800267 0.85 PTGDR2 (0.71) PTGDR2LIMK2
SCHEMBL13800265 0.85 PTGDR2 (0.71) PTGDR2LIMK2
SCHEMBL13800293 0.83 PTGDR2 (0.56) PTGDR2LIMK2PANK3CHRM4
SCHEMBL13800268 0.82 PTGDR2 (0.70) PTGDR2PANK3
SCHEMBL1713854 0.79 PTGDR2 (0.53) PTGDR2LIMK2CXCR3
SCHEMBL1714600 0.74 PTGDR2 (0.87) PTGDR2
SCHEMBL13813451 0.74 PTGDR2 (0.87) PTGDR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8524715-B2 Phenoxyacetic acid derivatives useful for treating respiratory diseases ASTRAZENECA AB (SE) 2013-09-03 — — US claimed
EP-1817282-B1 PHENOXYACETIC ACID DERIVATIVES USEFUL FOR TREATING RESPIRATORY DISEASES ASTRAZENECA AB (SE) 2011-07-20 — — EP claimed
US-20090149448-A1 Phenoxyacetic Acid Derivatives Useful for Treating Respiratory Diseases ASTRAZENECA AB (SE) 2009-06-11 — — US claimed
US-8524715-B2 Phenoxyacetic acid derivatives useful for treating respiratory diseases ASTRAZENECA AB (SE) 2013-09-03 — — US disclosed
EP-1817282-B1 PHENOXYACETIC ACID DERIVATIVES USEFUL FOR TREATING RESPIRATORY DISEASES ASTRAZENECA AB (SE) 2011-07-20 — — EP disclosed
US-20090149448-A1 Phenoxyacetic Acid Derivatives Useful for Treating Respiratory Diseases ASTRAZENECA AB (SE) 2009-06-11 — — 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 (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-20090149448-A1 Phenoxyacetic Acid Derivatives Useful for Treating Respiratory Diseases PAOX, PCCA, PAH PTGDR2 236/4885LIMK2 4556/4885CXCR3 3298/4885

“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.

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