SCHEMBL267944

SCHEMBL267944

CC(C)(C)OC(=O)N[C@@H](CCCN1CCCCC1)C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CTSK P43235 6/20 0.46
HDAC4 P56524 1/20 0.45
HDAC1 Q13547 1/20 0.45
HDAC6 Q9UBN7 1/20 0.45
CTSS P25774 3/20 0.44
ITGB3 P05106 9/20 0.44
ITGA2B P08514 9/20 0.44
ACHE P22303 1/20 0.42
BACE1 P56817 1/20 0.42
ALDH1A1 P00352 1/20 0.41
TSHR P16473 1/20 0.41
MEN1 O00255 1/20 0.40
GAA P10253 1/20 0.40
KMT2A Q03164 1/20 0.40

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
SCHEMBL21994806 0.99 CTSK (0.47) CTSKHDAC4HDAC1HDAC6CTSS
SCHEMBL21994809 0.99 CTSK (0.47) CTSKHDAC4HDAC1HDAC6CTSS
SCHEMBL21571117 0.96 HDAC4 (0.46) CTSKHDAC4HDAC1HDAC6CTSS
SCHEMBL20166296 0.96 HDAC4 (0.46) CTSKHDAC4HDAC1HDAC6CTSS
SCHEMBL27586355 0.96 HDAC4 (0.46) CTSKHDAC4HDAC1HDAC6CTSS
SCHEMBL21409067 0.92 CTSK (0.44) CTSKHDAC4HDAC1HDAC6CTSS
SCHEMBL21409064 0.92 CTSK (0.44) CTSKHDAC4HDAC1HDAC6CTSS
SCHEMBL30191484 0.88 CTSK (0.47) CTSKHDAC4HDAC1HDAC6CTSS
SCHEMBL21994419 0.87 CTSK (0.44) CTSKCTSSALDH1A1TSHRMEN1
SCHEMBL21994417 0.87 CTSK (0.44) CTSKCTSSALDH1A1TSHRMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9493402-B2 Omega-aminoalkylamides of R-2-aryl-propionic acids as inhibitors of the chemotaxis of polymorphonucleate and mononucleate cells DOMPÉ FARMACEUTICI S.P.A. (IT) 2016-11-15 US disclosed
EP-1366018-B1 OMEGA-AMINOALKYLAMIDES OF (R)-2-ARYL-PROPIONIC ACIDS AS INHIBITORS OF THE CHEMOTAXIS OF POLYMORPHONUCLEATE AND MONONUCLEATE CELLS DOMPÉ FARMACEUTICI S P A (IT) 2016-07-06 EP disclosed
US-20130079514-A1 \"OMEGA-AMINOALKYLAMIDES OF R-2-ARYL-PROPIONIC ACIDS AS INHIBITORS OF THE CHEMOTAXIS OF POLYMORPHONUCLEATE AND MONONUCLEATE CELLS\ Dompé S.p.A. (IT) 2013-03-28 US disclosed
US-8288368-B2 inhibitors of the C5a induced chemotaxis; psoriasis, ulcerative cholitis, glomerular nephritis, acute respiratory insufficiency, idiopathic fibrosis, rheumatoid arthritis and in the prevention and the treatment of injury caused by ischemia and reperfusion DOMPÉ PHA.R.MA S.P.A. (IT) 2012-10-16 US disclosed
US-8133864-B2 PAR-2 agonist KOWA COMPANY, LTD. (JP) 2012-03-13 US disclosed
EP-1864994-B1 PAR-2 AGONIST KOWA CO (JP) 2011-10-26 EP disclosed
US-20090215703-A1 PAR-2 Agonist KOWA COMPANY, LTD. (JP) 2009-08-27 US disclosed
EP-1864994-A1 PAR-2 AGONIST Kowa Company, Ltd. (JP) 2007-12-12 EP disclosed
US-20050080067-A1 Omega aminoalkylamides of R-2 aryl propionic acids as inhibitors of the chemotaxis of polymorphonucleate and mononucleate cells DOMPE S.P A. (IT) 2005-04-14 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 (3 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-20050080067-A1 Omega aminoalkylamides of R-2 aryl propionic acids as inhibitors of the chemotaxis of polymorphonucleate and mononucleate cells C5AR2, C3AR1, C5AR1 CTSK 2645/4885HDAC4 4511/4885HDAC1 3544/4885
US-20130079514-A1 \"OMEGA-AMINOALKYLAMIDES OF R-2-ARYL-PROPIONIC ACIDS AS INHIBITORS OF THE CHEMOTAXIS OF POLYMORPHONUCLEATE AND MONONUCLEATE CELLS\ C5AR2, C3AR1, C5AR1 CTSK 2872/4885HDAC4 3844/4885HDAC1 3219/4885
US-20090215703-A1 PAR-2 Agonist FPR2, F2RL1, FPR3 CTSK 2813/4885HDAC4 1751/4885HDAC1 2104/4885

“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.