SCHEMBL1853071

SCHEMBL1853071

O=C(O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C1(NC(=O)N2CCOCC2)CCCCC1

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ECE1 P42892 5/20 0.49
ALOX15 P16050 1/20 0.48
USP2 O75604 1/20 0.48
MAPK1 P28482 1/20 0.48
FAAH O00519 1/20 0.48
TRPV1 Q8NER1 1/20 0.48
ACE P12821 3/20 0.48
MMP2 P08253 1/20 0.47
MMP9 P14780 1/20 0.47
MMP8 P22894 1/20 0.47
ITGB2 P05107 2/20 0.47
ICAM1 P05362 2/20 0.47
ITGAL P20701 2/20 0.47
CCKBR P32239 3/20 0.47
KMT2A Q03164 1/20 0.47

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
SCHEMBL1837855 0.92 KMT2A (0.50) FAAHTRPV1MMP2MMP9MMP8
SCHEMBL5193392 0.85 ALOX15 (0.59) ECE1ALOX15ACEMMP2MMP9
SCHEMBL5964512 0.81 ACE (0.52) ECE1ACEITGB2ICAM1ITGAL
SCHEMBL5964517 0.81 ACE (0.52) ECE1ACEITGB2ICAM1ITGAL
SCHEMBL8360275 0.80 ALOX15 (0.61) ECE1ALOX15USP2MAPK1ACE
SCHEMBL7707507 0.80 ACE (0.62) ECE1ALOX15USP2MAPK1ACE
SCHEMBL5963727 0.79 ITGB2 (0.48) ECE1ALOX15USP2MAPK1ACE
SCHEMBL7338480 0.79 ALOX15 (0.61) ECE1ALOX15ACEITGB2ICAM1
SCHEMBL7338465 0.79 ALOX15 (0.61) ECE1ALOX15ACEITGB2ICAM1
SCHEMBL7230352 0.78 ACE (0.61) ECE1ALOX15ACEITGB2ICAM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8957205-B2 Cycloalkane carboxamide derivatives and production process of same SEIKAGAKU CORPORATION (JP) 2015-02-17 US disclosed
US-8481725-B2 Cycloalkylcarbonylamino acid derivative and process for producing the same SEIKAGAKU CORPORATION (JP) 2013-07-09 US disclosed
EP-1972636-B1 CYCLOALKYLCARBONYLAMINO ACID DERIVATIVE AND PROCESS FOR PRODUCING THE SAME SEIKAGAKU KOGYO CO LTD (JP) 2011-05-25 EP disclosed
US-20090156805-A1 Cycloalkane Carboxamide Derivatives and Production Process of Same SEIKAGAKU CORPORATION (JP) 2009-06-18 US disclosed
US-20090111983-A1 Cycloalkylcarbonylamino Acid Derivative and Process For Producing The Same SEIKAGAKU CORPORATION (JP) 2009-04-30 US disclosed
EP-1972636-A1 CYCLOALKYLCARBONYLAMINO ACID DERIVATIVE AND PROCESS FOR PRODUCING THE SAME SEIKAGAKU CORPORATION (JP) 2008-09-24 EP disclosed
EP-1972615-A1 CYCLOALKANECARBOXAMIDE DERIVATIVE AND METHOD FOR PRODUCING SAME SEIKAGAKU CORPORATION (JP) 2008-09-24 EP 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-20090156805-A1 Cycloalkane Carboxamide Derivatives and Production Process of Same CTSK, CTSS, CTSB ECE1 358/4885ALOX15 2180/4885USP2 1570/4885
US-20090111983-A1 Cycloalkylcarbonylamino Acid Derivative and Process For Producing The Same CTSK, CTSS, CTSV ECE1 613/4885ALOX15 2581/4885USP2 1402/4885

“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.