SCHEMBL13036085

SCHEMBL13036085

CCOC(=O)C(F)(F)C(O)[C@@H](NC(=O)C1CCCN1C(=O)[C@@H](NC(=O)OCc1ccccc1)C(C)C)C(C)C

nearest known ligand 0.55

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CMA1 P23946 11/20 0.55
ELANE P08246 8/20 0.54
MALT1 Q9UDY8 1/20 0.48

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
SCHEMBL8092357 0.92 CMA1 (0.58) CMA1ELANE
SCHEMBL13339328 0.89 ELANE (0.58) CMA1ELANE
SCHEMBL13036087 0.89 ELANE (0.58) CMA1ELANE
SCHEMBL7285949 0.86 CMA1 (0.53) CMA1ELANEMALT1
SCHEMBL7323606 0.86 CMA1 (0.53) CMA1ELANEMALT1
Hydrochloric Acid SCHEMBL7287630 0.86 CMA1 (0.50) CMA1ELANEMALT1
SCHEMBL10081595 0.84 ELANE (0.65) CMA1ELANE
SCHEMBL10080680 0.84 ELANE (0.57) CMA1ELANE
SCHEMBL7279072 0.84 CTSL (0.56) CMA1ELANE
SCHEMBL9871484 0.83 CAPN1 (0.54) CMA1ELANEMALT1

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
EP-2170270-B1 COMPOSITIONS FOR DELIVERING MEDICAMENTS INTO THE LUNGS, USES THEREOF PAKA PULMONARY PHARMACEUTICALS INC (US) 2016-01-13 EP disclosed
US-20140378383-A1 METHODS AND COMPOSITIONS FOR DELIVERY OF MEDICAMENTS TO THE LUNGS PAKA PULMONARY PHARMACEUTICALS, INC. 2014-12-25 US disclosed
US-20100284969-A1 Methods and Compositions for Delivery of Medicaments to the Lungs SOLMAP PHARMACEUTICALS, INC. 2010-11-11 US disclosed
WO-2010068754-A2 METHODS AND COMPOSITIONS FOR DELIVERY OF MEDICAMENTS TO THE LUNGS PAKA PULMONARY PHARMACEUTICALS, INC. (US) 2010-06-17 WO disclosed
WO-2008151235-A2 COMPOSITIONS FOR DELIVERING MEDICAMENTS INTO THE LUNGS, USES THEREOF FORMA THERAPEUTICS, INC. (US) 2008-12-11 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 (2 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-20100284969-A1 Methods and Compositions for Delivery of Medicaments to the Lungs SMPD1, SMPD3, SGMS1 CMA1 409/4885ELANE 28/4885MALT1 4765/4885
US-20140378383-A1 METHODS AND COMPOSITIONS FOR DELIVERY OF MEDICAMENTS TO THE LUNGS SMPD1, SMPD3, SGMS1 CMA1 409/4885ELANE 28/4885MALT1 4765/4885

“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.