SCHEMBL1459405

SCHEMBL1459405

CC(CO)c1ccccc1CCC(=O)c1cccc(C=Cc2ccc3ccc(Cl)cc3n2)c1

nearest known ligand 0.51

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ PTGER1 P34995 1/20 0.49
▸ PTGER4 P35408 1/20 0.49
▸ PTGER3 P43115 1/20 0.49
▸ PTGER2 P43116 1/20 0.49
▸ CYSLTR2 Q9NS75 2/20 0.49
▸ CYSLTR1 Q9Y271 2/20 0.49

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
SCHEMBL9691074 0.90 CYSLTR2 (0.50) CYSLTR2CYSLTR1
SCHEMBL9691066 0.90 CYSLTR2 (0.50) CYSLTR2CYSLTR1
SCHEMBL8500089 0.87 CYSLTR2 (0.49) PTGER1PTGER4PTGER3PTGER2CYSLTR2
SCHEMBL8500086 0.87 CYSLTR2 (0.49) PTGER1PTGER4PTGER3PTGER2CYSLTR2
SCHEMBL9691037 0.86 CYSLTR2 (0.49) CYSLTR2CYSLTR1
SCHEMBL9691042 0.86 CYSLTR2 (0.49) CYSLTR2CYSLTR1
SCHEMBL13950635 0.86 CYSLTR2 (0.50) PTGER1PTGER4PTGER3PTGER2CYSLTR2
SCHEMBL692870 0.83 CYSLTR2 (0.52) PTGER1PTGER4PTGER3PTGER2CYSLTR2
SCHEMBL692871 0.83 CYSLTR2 (0.52) PTGER1PTGER4PTGER3PTGER2CYSLTR2
SCHEMBL8496429 0.82 CYSLTR1 (0.49) CYSLTR2CYSLTR1

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
EP-2474535-B1 SYNTHETIC METHOD OF MONTELUKAST SODIUM INTERMEDIATE SHANDONG NEW TIME PHARMACEUTICAL CO LTD (CN) 2014-07-02 — — EP claimed
US-8569508-B2 Synthetic method for montelukast sodium intermediate SHANDONG NEW TIME PHARMACEUTICAL CO., LTD. (CN) 2013-10-29 — — US claimed
EP-2474535-A1 SYNTHETIC METHOD OF MONTELUKAST SODIUM INTERMEDIATE Shandong New Time Pharmaceutical Co., Ltd. (CN) 2012-07-11 — — EP claimed
US-20120165535-A1 SYNTHETIC METHOD FOR MONTELUKAST SODIUM INTERMEDIATE SHANDONG NEW TIME PHARMACEUTICAL CO. LTD. (CN) 2012-06-28 — — US claimed
US-8569508-B2 Synthetic method for montelukast sodium intermediate SHANDONG NEW TIME PHARMACEUTICAL CO., LTD. (CN) 2013-10-29 — — US disclosed
EP-2474535-A1 SYNTHETIC METHOD OF MONTELUKAST SODIUM INTERMEDIATE Shandong New Time Pharmaceutical Co., Ltd. (CN) 2012-07-11 — — EP disclosed
US-20120165535-A1 SYNTHETIC METHOD FOR MONTELUKAST SODIUM INTERMEDIATE SHANDONG NEW TIME PHARMACEUTICAL CO. LTD. (CN) 2012-06-28 — — US disclosed
WO-2011026398-A1 SYNTHETIC METHOD OF MONTELUKAST SODIUM INTERMEDIATE 山东新时代药业有限公司 (CN) 2011-03-10 — — 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-20120165535-A1 SYNTHETIC METHOD FOR MONTELUKAST SODIUM INTERMEDIATE LTC4S, CMA1, PTGIS PTGER1 481/4885PTGER4 308/4885PTGER3 340/4885

“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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