SCHEMBL4274302

SCHEMBL4274302

CC(C)(C)OC(=O)N[C@@H]1C=CC(C(=O)O)C1

nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
NFKB1 P19838 5/20 0.53
NFKB2 Q00653 5/20 0.53
RELA Q04206 5/20 0.53
BTK Q06187 1/20 0.48
KDM1A O60341 2/20 0.39
MAOB P27338 1/20 0.39
CTSK P43235 2/20 0.38
KMT2A Q03164 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
GAA P10253 1/20 0.37
EPHX2 P34913 1/20 0.36

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
SCHEMBL1078254 1.00 NFKB1 (0.53) NFKB1NFKB2RELABTKKDM1A
SCHEMBL2137399 1.00 NFKB1 (0.53) NFKB1NFKB2RELABTKKDM1A
SCHEMBL12951153 1.00 NFKB1 (0.53) NFKB1NFKB2RELABTKKDM1A
SCHEMBL4951462 1.00 NFKB1 (0.53) NFKB1NFKB2RELABTKKDM1A
SCHEMBL605621 1.00 NFKB1 (0.53) NFKB1NFKB2RELABTKKDM1A
SCHEMBL605148 1.00 NFKB1 (0.53) NFKB1NFKB2RELABTKKDM1A
SCHEMBL5270119 1.00 NFKB1 (0.53) NFKB1NFKB2RELABTKKDM1A
SCHEMBL605147 1.00 NFKB1 (0.53) NFKB1NFKB2RELABTKKDM1A
SCHEMBL15215795 0.87 NFKB1 (0.53) NFKB1NFKB2RELABTKKDM1A
SCHEMBL19337828 0.86 NFKB1 (0.51) NFKB1NFKB2RELABTKKDM1A

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
EP-2448916-B1 PRODUCTION OF TRANS-4-AMINOCYCLOPENT-2-ENE-1-CARBOXYLIC ACID DERIVATIVES REDDYS LAB LTD DR (IN) 2014-09-03 EP disclosed
US-8524943-B2 Production of trans-4-aminocyclopent-2-ene-1-carboxylic acid derivatives DR. REDDY'S LABORATORIES, INC. (US) 2013-09-03 US disclosed
WO-2011003061-A2 PRODUCTION OF TRAN S-4-AMINOCYCLOPENT-2-ENE-1-CARBOXYLIC ACID DERIVATIVES DR. REDDY'S LABORATORIES LTD. (IN) 2011-01-06 WO disclosed
EP-1763347-A4 3-AMINOCYCLOPENTANECARBOXAMIDES AS MODULATORS OF CHEMOKINE RECEPTORS INCYTE CORP (US) 2009-05-20 EP disclosed
US-20080076824-A1 modified glycinamides: Valine-alphahydroxy-glycinamide CHRONTECH PHARMA AB (SE) 2008-03-27 US disclosed
EP-1763347-A2 3-AMINOCYCLOPENTANECARBOXAMIDES AS MODULATORS OF CHEMOKINE RECEPTORS Incyte Corporation (US) 2007-03-21 EP disclosed
EP-1746997-A2 3-(4-HETEROARYLCYCLOHEXYLAMINO) CZCLOPENTANECARBOXAMIDES AS MODULATORS OF CHEMOKINE RECEPTORS Incyte Corporation (US) 2007-01-31 EP disclosed
WO-2006004741-A2 3-AMINOCYCLOPENTANECARBOXAMIDES AS MODULATORS OF CHEMOKINE RECEPTORS INCYTE CORPORATION (US) 2006-01-12 WO disclosed
WO-2005115392-A2 3-(4-HETEROARYLCYCLOHEXYLAMINO) CYCLOPENTANECARBOXAMIDES AS MODULATORS OF CHEMOKINE RECEPTORS INCYTE CORPORATION (US) 2005-12-08 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-20080076824-A1 modified glycinamides: Valine-alphahydroxy-glycinamide GALE, ENGASE, UGGT1 NFKB1 2666/4885NFKB2 3295/4885RELA 1552/4885

“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.