SCHEMBL2134159

SCHEMBL2134159

COC(=O)C1C=CC(NC(=O)OC(C)(C)C)C1

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NFKB1 P19838 5/20 0.51
NFKB2 Q00653 5/20 0.51
RELA Q04206 5/20 0.51
BTK Q06187 1/20 0.40
CTSK P43235 2/20 0.38
KDM1A O60341 2/20 0.37
GAA P10253 1/20 0.36
MAOB P27338 1/20 0.36
EPHX1 P07099 1/20 0.35
EPHX2 P34913 1/20 0.35
KMT2A Q03164 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34

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
SCHEMBL4146153 1.00 NFKB1 (0.51) NFKB1NFKB2RELABTKCTSK
SCHEMBL28572940 1.00 NFKB1 (0.51) NFKB1NFKB2RELABTKCTSK
SCHEMBL2134157 1.00 NFKB1 (0.51) NFKB1NFKB2RELABTKCTSK
SCHEMBL13334908 1.00 NFKB1 (0.51) NFKB1NFKB2RELABTKCTSK
SCHEMBL12951314 1.00 NFKB1 (0.51) NFKB1NFKB2RELABTKCTSK
SCHEMBL31454795 1.00 NFKB1 (0.51) NFKB1NFKB2RELABTKCTSK
SCHEMBL605621 0.86 NFKB1 (0.53) NFKB1NFKB2RELABTKCTSK
SCHEMBL4951462 0.86 NFKB1 (0.53) NFKB1NFKB2RELABTKCTSK
SCHEMBL5270119 0.86 NFKB1 (0.53) NFKB1NFKB2RELABTKCTSK
SCHEMBL605148 0.86 NFKB1 (0.53) NFKB1NFKB2RELABTKCTSK

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 46 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102557990-B Preparation method for (4-substituted amide)-2-cyclopentene-1-carboxylate raceme and single enantiomer thereof KAIYUAN HENGTAI CHEMICAL CO LTD 2014-06-25 CN claimed
CN-102372657-A Synthesis method of anti-influenza and avian influenza virus resistant medicine peramivir UNIV JINAN 2012-03-14 CN claimed
EP-3892278-B1 CYCLOALKANE-1,3-DIAMINE DERIVATIVE DAIICHI SANKYO CO LTD (JP) 2024-02-28 EP disclosed
CN-115504908-A Preparation method of (1S, 4R) -4-tert-butoxycarbonylamino-cyclopent-2-alkenyl-1-methyl formate 桂林南药股份有限公司 2022-12-23 CN disclosed
EP-3892278-A1 CYCLOALKANE-1,3-DIAMINE DERIVATIVE Daiichi Sankyo Company, Limited (JP) 2021-10-13 EP disclosed
WO-2020116662-A1 CYCLOALKANE-1,3-DIAMINE DERIVATIVE 第一三共株式会社 2020-06-11 WO disclosed
EP-2834234-B1 FUSED CYCLOPENTYL ANTAGONISTS OF CCR2 JANSSEN PHARMACEUTICA NV (BE) 2017-09-13 EP disclosed
EP-2834234-B1 FUSED CYCLOPENTYL ANTAGONISTS OF CCR2 JANSSEN PHARMACEUTICA NV (BE) 2017-09-13 EP disclosed
EP-1763351-B9 3-AMINOCYCLOPENTANECARBOXAMIDES AS MODULATORS OF CHEMOKINE RECEPTORS INCYTE HOLDINGS CORP (US) 2017-05-31 EP disclosed
EP-1763351-B1 3-AMINOCYCLOPENTANECARBOXAMIDES AS MODULATORS OF CHEMOKINE RECEPTORS INCYTE HOLDINGS CORP (US) 2016-11-30 EP disclosed
US-9150532-B2 Fused cyclopentyl antagonists of CCR2 JANSSEN PHARMACEUTICA NV (BE) 2015-10-06 US disclosed
US-7038059-B2 Process for preparation of 4-n-substituted amino-2-aza-1-oxabicyclo[3.3.0] oct-2-ene-6-carboxylic acid esters and process for preparation of their intermediates KURARAY CO., LTD. (JP) 2006-05-02 US disclosed
US-20040121482-A1 Process for preparation of 4-n-substituted amino-2-aza-1-oxabicyclo[3.3.0] oct-2-ene-6-carboxylic acid esters and process for preparation of their intermediates KURARAY CO., LTD. (JP) 2004-06-24 US disclosed
EP-1334969-A1 PROCESS FOR PREPARATION OF 4-N-SUBSTITUTED AMINO-2-AZA-1-OXABICYCLO 3.3.0]OCT-2-ENE-6-CARBOXYLIC ACID ESTERS AND PROCESS FOR PREPARATION OF THEIR INTERMEDIATES KURARAY CO., LTD. (JP) 2003-08-13 EP disclosed
US-6503745-B1 Method of detecting influenza virus, comprising the step of exposing a sample suspected to comprise influenza virus to at least one compound according to claim 1, wherein the at least one compound is capable of binding specifically to the active BIOCRYST PHARMACEUTICALS, INC. 2003-01-07 US disclosed
US-6495711-B2 1-(TERT-BUTOXYCARBONYLAMINO)-4-METHOXYCARBONYL-CYCLOPENT-2-ENE STARTING BY REACTING 2-AZABICYCLO(2.2.1)HEPT-5-EN-3-ONE WITH AN ALCOHOL AND NONAQUEOUS ACID; CHEMICAL INTERMEDIATES TO ANTIVIRAL AGENTS AGAINST INFLUENZA VIRUS BIOCRYST PHARMACEUTICALS INC. 2002-12-17 US disclosed
EP-1206443-A2 PROCESS FOR PREPARING (-)-(1S,4R) N-PROTECTED 4-AMINO-2-CYCLOPENTENE-1-CARBOXYLATE ESTERS BIOCRYST PHARMACEUTICALS, INC. (US) 2002-05-22 EP disclosed
US-20020052524-A1 Process for preparing (-)-(1S, 4R) N-protected 4-amino-2-cyclopentene-1-carboxylate esters BIOCRYST PHARMACEUTICALS, INC. 2002-05-02 US disclosed
WO-2001001569-A2 PROCESS FOR PREPARING (-)-(1S,4R) N-PROTECTED 4-AMINO-2-CYCLOPENTENE-1-CARBOXYLATE ESTERS ORTHO-MCNEIL PHARMACEUTICAL, INC. (US) 2001-01-04 WO disclosed
WO-2000028328-A1 NEW CYCLOPENTANE AND CYCLOPENTENE COMPOUNDS AND USE FOR DETECTING INFLUENZA VIRUS BIOCRYST PHARMACEUTICALS, INC. (US) 2000-05-18 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-20020052524-A1 Process for preparing (-)-(1S, 4R) N-protected 4-amino-2-cyclopentene-1-carboxylate esters CPNE4, PYM1, CCNT1 NFKB1 2824/4885NFKB2 3410/4885RELA 3781/4885

“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.