SCHEMBL13036084

SCHEMBL13036084

CC(C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCC1C(=O)N[C@H](C=O)C(C)C

nearest known ligand 0.55

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ELANE P08246 7/20 0.55
CMA1 P23946 5/20 0.55
CAPN1 P07384 2/20 0.53
CTSL P07711 1/20 0.52
CTSB P07858 1/20 0.52
CTSK P43235 1/20 0.52
PREP P48147 2/20 0.52
CCR1 P32246 1/20 0.51

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
SCHEMBL7293993 1.00 ELANE (0.55) ELANECMA1CAPN1CTSLCTSB
SCHEMBL7276583 1.00 ELANE (0.55) ELANECMA1CAPN1CTSLCTSB
SCHEMBL13982069 1.00 ELANE (0.55) ELANECMA1CAPN1CTSLCTSB
Sulfurous Acid SCHEMBL7313834 0.97 ELANE (0.53) ELANECMA1CAPN1CTSLCTSB
SCHEMBL7323599 0.94 ELANE (0.51) ELANECMA1CAPN1CTSLCTSB
SCHEMBL7313928 0.92 CMA1 (0.55) ELANECMA1
SCHEMBL7317148 0.89 MALT1 (0.61) ELANECMA1CTSLCTSBPREP
SCHEMBL7324440 0.88 MALT1 (0.59) ELANECMA1
SCHEMBL17425092 0.87 CMA1 (0.56) ELANECMA1CAPN1CTSLCTSB
SCHEMBL7320470 0.87 CMA1 (0.51) ELANECMA1

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-9289388-B2 Methods and compositions for delivery of medicaments to the lungs PAKA PULMONARY PHARMACEUTICALS, INC. (US) 2016-03-22 US disclosed
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 ELANE 28/4885CMA1 409/4885CAPN1 1543/4885
US-20140378383-A1 METHODS AND COMPOSITIONS FOR DELIVERY OF MEDICAMENTS TO THE LUNGS SMPD1, SMPD3, SGMS1 ELANE 28/4885CMA1 409/4885CAPN1 1543/4885

“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.