SCHEMBL649444

SCHEMBL649444

CNC(=O)COC(=O)NCCC[C@H]1OC[C@H](c2cccc3cc(OC)ccc32)CO1

nearest known ligand 0.83

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ACACB O00763 7/20 0.60
MTNR1A P48039 9/20 0.39
MTNR1B P49286 3/20 0.39
NQO2 P16083 1/20 0.39
ACACA Q13085 3/20 0.36
DRD2 P14416 1/20 0.35
DRD3 P35462 1/20 0.35
KDM4E B2RXH2 1/20 0.34
ALDH1A1 P00352 1/20 0.34
BRD4 O60885 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
SCHEMBL649910 1.00 ACACB (0.60) ACACBMTNR1AMTNR1BNQO2ACACA
SCHEMBL648245 0.95 ACACB (0.53) ACACBMTNR1AMTNR1BNQO2KDM4E
SCHEMBL648246 0.95 ACACB (0.53) ACACBMTNR1AMTNR1BNQO2KDM4E
SCHEMBL649232 0.93 ACACB (0.51) ACACBMTNR1AMTNR1B
SCHEMBL649231 0.93 ACACB (0.51) ACACBMTNR1AMTNR1B
SCHEMBL650375 0.92 ACACB (0.59) ACACBMTNR1AMTNR1BNQO2ACACA
SCHEMBL650374 0.92 ACACB (0.59) ACACBMTNR1AMTNR1BNQO2ACACA
SCHEMBL648433 0.91 ACACB (0.61) ACACBMTNR1AMTNR1BNQO2ACACA
SCHEMBL648434 0.91 ACACB (0.61) ACACBMTNR1AMTNR1BNQO2ACACA
SCHEMBL647847 0.91 ACACB (0.59) ACACBMTNR1AMTNR1BNQO2DRD2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8119687-B2 Derivatives of dioxan-2-alkyl carbamates, preparation thereof and application thereof in therapeutics SANOFI-AVENTIS (FR) 2012-02-21 US claimed
US-20100280076-A1 DERIVATIVES OF DIOXAN-2-ALKYL CARBAMATES, PREPARATION THEREOF AND APPLICATION THEREOF IN THERAPEUTICS SANOFI-AVENTIS (FR) 2010-11-04 US claimed
US-20090286868-A1 DERIVATIVES OF DIOXAN-2-ALKYL CARBAMATES, PREPARATION THEREOF AND APPLICATION THEREOF IN THERAPEUTICS SANOFI-AVENTIS (FR) 2009-11-19 US claimed
EP-1537096-B1 DERIVATIVES OF DIOXANE-2-ALKYL CARBAMATES, PREPARATION METHOD THEREOF AND APPLICATION OF SAME IN THERAPEUTICS SANOFI AVENTIS (FR) 2008-09-24 EP claimed
US-20060247290-A1 DERIVATIVES OF DIOXAN-2-ALKYL CARBAMATES, PREPARATION THEREOF AND APPLICATION THEREOF IN THERAPEUTICS SANOFI-AVENTIS (FR) 2006-11-02 US claimed
US-7119116-B2 Derivatives of dioxane-2-alkyl carbamates, preparation thereof and application thereof in therapeutics SANOFI-AVENTIS (FR) 2006-10-10 US claimed
US-20050182130-A1 Derivatives of dioxane-2-alkyl carbamates, preparation thereof and application thereof in therapeutics SANOFI AVENTIS (FR) 2005-08-18 US claimed
US-20040224019-A1 Oral controlled release system for targeted drug delivery into the cell and its nucleus for gene therapy, DNA vaccination, and administration of gene based drugs SALVONA-IP LLC 2004-11-11 US claimed
US-20210007990-A1 COMPOSITIONS FOR STABILIZING AND DELIVERING PROTEINS THERAPYX, INC. 2021-01-14 US disclosed
EP-2561854-B1 Particles that disrupt or impede bacterial adhesion, related compositions and methods COLGATE PALMOLIVE CO (US) 2016-06-08 EP disclosed
EP-1948124-B1 PARTICLES THAT INHIBIT OR REDUCE BACTERIAL ADHESION ON AN ORAL SURFACE, RELATED COMPOSITIONS AND METHODS COLGATE PALMOLIVE CO (US) 2016-05-11 EP disclosed
EP-1423175-B1 METHODS FOR MICRONIZATION OF HYDROPHOBIC DRUGS UNIV BROWN RES FOUND (US) 2013-10-02 EP disclosed
EP-2561854-A1 Particles that disrupt or impede bacterial adhesion, related compositions and methods Colgate-Palmolive Company (US) 2013-02-27 EP disclosed
US-8211452-B2 Particles that disrupt or impede bacterial adhesion, related compositions and methods COLGATE-PALMOLIVE COMPANY (US) 2012-07-03 US disclosed
US-6248720-B1 NONINVASIVE DRUG DELIVERY OF BIOADHESIVE, MICROENCAPSULATED MICROPARTICLES CONTAINING A GENE UNDER THE CONTROL OF A PROMOTER TO A MUCOSAL EPITHELIAL SURFACE BROWN UNIVERSITY RESEARCH FOUNDATION 2001-06-19 US disclosed
US-6235224-B1 DISSOLVING POLYMER IN SOLVENT, DISSOLVING OR DISPERSING AGENT TO BE ENCAPSULATED IN SAID SOLVENT, INTRODUCING MIXTURE INTO NONSOLVENT TO CAUSE SPONTANEOUS FORMATION OF MICROENCAPSULATED PRODUCT BROWN UNIVERSITY RESEARCH FOUNDATION 2001-05-22 US disclosed
US-6143211-A FORMING A MIXTURE OF A POLYMER AND A SOLVENT, WHEREIN THE SOLVENT IS PRESENT IN A CONTINUOUS PHASE AND INTRODUCING THE MIXTURE INTO AN EFFECTIVE AMOUNT OF A NONSOLVENT TO CAUSE THE SPONTANEOUS FORMATION OF MICROPARTICLES BROWN UNIVERSITY FOUNDATION (US) 2000-11-07 US disclosed
EP-0844871-A4 A PROCESS FOR PREPARING MICROPARTICLES THROUGH PHASE INVERSION PHENOMENA UNIV BROWN RES FOUND (US) 1999-03-17 EP disclosed
EP-0844871-A1 A PROCESS FOR PREPARING MICROPARTICLES THROUGH PHASE INVERSION PHENOMENA BROWN UNIVERSITY RESEARCH FOUNDATION (US) 1998-06-03 EP disclosed
WO-1997003657-A1 A PROCESS FOR PREPARING MICROPARTICLES THROUGH PHASE INVERSION PHENOMENA BROWN UNIVERSITY RESEARCH FOUNDATION (US) 1997-02-06 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 (4 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-20100280076-A1 DERIVATIVES OF DIOXAN-2-ALKYL CARBAMATES, PREPARATION THEREOF AND APPLICATION THEREOF IN THERAPEUTICS CHRM3, CHRM2, CHRM4 ACACB 829/4885MTNR1A 466/4885MTNR1B 1041/4885
US-20060247290-A1 DERIVATIVES OF DIOXAN-2-ALKYL CARBAMATES, PREPARATION THEREOF AND APPLICATION THEREOF IN THERAPEUTICS CHRM3, CHRM2, CHRM4 ACACB 829/4885MTNR1A 466/4885MTNR1B 1041/4885
US-20050182130-A1 Derivatives of dioxane-2-alkyl carbamates, preparation thereof and application thereof in therapeutics CHRM3, CHRM2, CHRM4 ACACB 681/4885MTNR1A 540/4885MTNR1B 1234/4885
US-20090286868-A1 DERIVATIVES OF DIOXAN-2-ALKYL CARBAMATES, PREPARATION THEREOF AND APPLICATION THEREOF IN THERAPEUTICS CHRM3, CHRM2, CHRM4 ACACB 829/4885MTNR1A 466/4885MTNR1B 1041/4885

“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.