SCHEMBL6795979

SCHEMBL6795979

COC(=O)C=CCC1CCN(C(=O)OC(C)(C)C)CC1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.47
PKM P14618 1/20 0.47
EPHX1 P07099 1/20 0.46
HPGD P15428 1/20 0.45
ALDH1A1 P00352 2/20 0.43
FAAH O00519 1/20 0.43
RECQL P46063 1/20 0.43
PTPN2 P17706 1/20 0.42
PTPN1 P18031 1/20 0.42
PTPN6 P29350 1/20 0.42
GLS O94925 1/20 0.42
GPR119 Q8TDV5 5/20 0.41
USP2 O75604 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
NPC1 O15118 1/20 0.40
MAPT P10636 1/20 0.40
MAPK1 P28482 1/20 0.40
HTT P42858 1/20 0.40
RAB9A P51151 1/20 0.40
L3MBTL1 Q9Y468 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
SCHEMBL6795973 1.00 KDM4E (0.47) KDM4EPKMEPHX1HPGDALDH1A1
SCHEMBL20071876 1.00 KDM4E (0.47) KDM4EPKMEPHX1HPGDALDH1A1
SCHEMBL22907013 0.88 HPGD (0.47) KDM4EPKMEPHX1HPGDALDH1A1
SCHEMBL7285037 0.87 KDM4E (0.43) KDM4EPKMEPHX1HPGDALDH1A1
SCHEMBL7282919 0.87 KDM4E (0.43) KDM4EPKMEPHX1HPGDALDH1A1
SCHEMBL10154181 0.83 HPGD (0.49) KDM4EPKMEPHX1HPGDFAAH
SCHEMBL10190477 0.83 HPGD (0.49) KDM4EPKMEPHX1HPGDFAAH
SCHEMBL1186709 0.82 HPGD (0.48) KDM4EPKMEPHX1HPGDFAAH
SCHEMBL1186705 0.82 HPGD (0.48) KDM4EPKMEPHX1HPGDFAAH
SCHEMBL12873549 0.82 HPGD (0.48) KDM4EPKMEPHX1HPGDFAAH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3526203-B1 N-ARYL AND N-HETEROARYL PIPERIDINE DERIVATIVES AS LIVER X RECEPTOR BETA AGONISTS, COMPOSITIONS, AND THEIR USE MERCK SHARP & DOHME (US) 2021-09-22 EP disclosed
US-10961215-B2 N-aryl and N-heteroaryl piperidine derivatives as liver X receptor beta agonists, compositions, and their use MERCK SHARP & DOHME CORP. (US) 2021-03-30 US disclosed
US-20200039951-A1 N-ARYL AND N-HETEROARYL PIPERIDINE DERIVATIVES AS LIVER X RECEPTOR BETA AGONISTS, COMPOSITIONS, AND THEIR USE MERCK SHARP & DOHME CORP. (US) 2020-02-06 US disclosed
US-8110683-B2 Piperidinyl compounds that selectively bind integrins JANSSEN PHARMACEUTICA N.V. (BE) 2012-02-07 US disclosed
US-20110092528-A1 PIPERIDINYL COMPOUNDS THAT SELECTIVELY BIND INTEGRINS DE CORTE BART 2011-04-21 US disclosed
US-7879881-B2 1-[[3-[(1,4,5,6-Tetrahydro-2-pyrimidinyl)amino]phenyl]acetyl]-4-piperidinepropanoic acid; new class of selective modulator of beta 3, beta 5 or dual integrin receptors; anticarcinogenic, antiinflammatory, antidiabetic agent JANSSEN PHARMACEUTICA NV (BE) 2011-02-01 US disclosed
US-20080058359-A1 Piperidinyl compounds that selectively bind integrins JANSSEN PHARMACEUTICA, N.V. (BE) 2008-03-06 US disclosed
US-6797700-B2 ANTICOAGULANTS AVENTIS PHARMACEUTICALS, INC. 2004-09-28 US disclosed
US-20020002268-A1 Antithrombotic azacycloalkylalkanoyl peptides and pseudopeptides AVENTIS PHARMACEUTICALS INC. 2002-01-03 US disclosed
US-6274705-B1 INHIBIT PLATELET AGGREGATION AND THROMBUS FORMATION, USEFUL IN PREVENTION AND TREATMENT OF THROMBOSIS AVENTIS PHARMACEUTICALS PRODUCTS INC. 2001-08-14 US disclosed
EP-0812205-B1 ANTITHROMBOTIC AZACYCLOALKYLALKANOYL PEPTIDES AND PSEUDOPEPTIDES RHONE POULENC RORER PHARMA (US) 2001-03-14 EP disclosed
EP-0812205-A4 ANTITHROMBOTIC AZACYCLOALKYLALKANOYL PEPTIDES AND PSEUDOPEPTIDES RHONE POULENC RORER PHARMA (US) 1999-03-31 EP disclosed
US-5866685-A Antithrombotic azacycloalkylalkanoyl peptides and pseudopeptides RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 1999-02-02 US disclosed
EP-0812205-A1 ANTITHROMBOTIC AZACYCLOALKYLALKANOYL PEPTIDES AND PSEUDOPEPTIDES RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 1997-12-17 EP disclosed
WO-1995010295-A1 ANTITHROMBOTIC AZACYCLOALKYLALKANOYL PEPTIDES AND PSEUDOPEPTIDES RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 1995-04-20 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 (5 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-20080058359-A1 Piperidinyl compounds that selectively bind integrins ITGB3, ITGAV, ITGA2B KDM4E 3297/4885PKM 3959/4885EPHX1 2887/4885
US-20020002268-A1 Antithrombotic azacycloalkylalkanoyl peptides and pseudopeptides PLAT, SELP, PIGS KDM4E 4235/4885PKM 3149/4885EPHX1 1217/4885
US-20200039951-A1 N-ARYL AND N-HETEROARYL PIPERIDINE DERIVATIVES AS LIVER X RECEPTOR BETA AGONISTS, COMPOSITIONS, AND THEIR USE NR1H2, NR1H3, NR1H4 KDM4E 2692/4885PKM 2780/4885EPHX1 658/4885
US-10961215-B2 N-aryl and N-heteroaryl piperidine derivatives as liver X receptor beta agonists, compositions, and their use NR1H2, NR1H3, NR1H4 KDM4E 2692/4885PKM 2780/4885EPHX1 658/4885
US-20110092528-A1 PIPERIDINYL COMPOUNDS THAT SELECTIVELY BIND INTEGRINS ITGB3, ITGAV, ITGA2B KDM4E 3297/4885PKM 3959/4885EPHX1 2887/4885

“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.