SCHEMBL1397232

SCHEMBL1397232

C=C(C)c1ccccc1CCCCc1cccc(C=Cc2ccc3ccc(Cl)cc3n2)c1

nearest known ligand 0.51

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ CYSLTR2 Q9NS75 3/20 0.45
▸ CYSLTR1 Q9Y271 3/20 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
SCHEMBL1397268 1.00 CYSLTR2 (0.45) CYSLTR2CYSLTR1
SCHEMBL12856340 0.98 CYSLTR2 (0.45) CYSLTR2CYSLTR1
SCHEMBL14620846 0.89 CYSLTR2 (0.44) CYSLTR2CYSLTR1
SCHEMBL12267469 0.89 CYSLTR2 (0.49) CYSLTR2CYSLTR1
SCHEMBL18192997 0.87 CYSLTR2 (0.46) CYSLTR2CYSLTR1
SCHEMBL14527479 0.85 CYSLTR1 (0.49) CYSLTR2CYSLTR1
SCHEMBL18192993 0.85 CYSLTR2 (0.48) CYSLTR2CYSLTR1
SCHEMBL14527588 0.84 — —
SCHEMBL10224774 0.84 CYSLTR1 (0.49) CYSLTR2CYSLTR1
SCHEMBL12597691 0.83 — —

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
WO-2009144742-A3 AN IMPROVED PROCESS FOR PREPARING MONTELUKAST AND SALTS THEREOF APTUIT LAURUS PVT LIMITED (IN) 2014-09-04 — — WO disclosed
US-8367834-B2 Process for preparing Montelukast and salts thereof LAURUS LABS PRIVATE LIMITED (IN) 2013-02-05 — — US disclosed
US-20110112300-A1 IMPROVED PROCESS FOR PREPARING MONTELUKAST AND SALTS THEREOF Aptuit Laurus Pvt. Ltd. (IN) 2011-05-12 — — US disclosed
EP-2288595-A2 AN IMPROVED PROCESS FOR PREPARING MONTELUKAST AND SALTS THEREOF Aptuit Laurus Pvt Limited (IN) 2011-03-02 — — EP disclosed
WO-2009144742-A2 AN IMPROVED PROCESS FOR PREPARING MONTELUKAST AND SALTS THEREOF APTUIT LAURUS PVT LIMITED (IN) 2009-12-03 — — 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-20110112300-A1 IMPROVED PROCESS FOR PREPARING MONTELUKAST AND SALTS THEREOF MPST, TST, CMA1 CYSLTR2 14/4885CYSLTR1 11/4885

“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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