SCHEMBL2657710

SCHEMBL2657710

O=C1OC2(CCN(c3cnc(-c4ccccc4)cn3)CC2)c2ccccc21

nearest known ligand 0.64

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
NPY5R Q15761 15/20 0.64
HSD11B1 P28845 1/20 0.53
DGAT1 O75907 1/20 0.51
SIGMAR1 Q99720 1/20 0.50
AVPR1A P37288 2/20 0.49

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
SCHEMBL4577327 0.91 NPY5R (0.57) NPY5RHSD11B1DGAT1AVPR1A
SCHEMBL4577476 0.88 NPY5R (0.55) NPY5RHSD11B1DGAT1AVPR1A
SCHEMBL6054773 0.87 AVPR1A (0.54) NPY5RHSD11B1DGAT1AVPR1A
SCHEMBL6054873 0.87 AVPR1A (0.54) NPY5RHSD11B1DGAT1AVPR1A
SCHEMBL4016619 0.85 NPY5R (0.48) NPY5RHSD11B1DGAT1SIGMAR1AVPR1A
SCHEMBL6054824 0.83 NPY5R (0.66) NPY5RHSD11B1DGAT1SIGMAR1AVPR1A
SCHEMBL918154 0.78 NPY5R (1.00) NPY5R
SCHEMBL5785900 0.77 NPY5R (0.62) NPY5R
SCHEMBL5433417 0.76 NPY5R (0.48) NPY5RHSD11B1SIGMAR1
SCHEMBL4047630 0.75 NPY5R (0.53) NPY5RDGAT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1534074-A4 COMBINATION THERAPY FOR THE TREATMENT OF OBESITY MERCK & CO INC (US) 2008-01-09 EP claimed
EP-1534074-A2 COMBINATION THERAPY FOR THE TREATMENT OF OBESITY Merck & Co., Inc. (US) 2005-06-01 EP claimed
WO-2004009015-A2 COMBINATION THERAPY FOR THE TREATMENT OF OBESITY MERCK & CO., INC. (US) 2004-01-29 WO claimed
EP-2906040-A1 NOVEL BENZIMIDAZOLE TETRAHYDROPYRAN DERIVATIVES Merck Sharp & Dohme Corp. (US) 2015-08-19 EP disclosed
EP-2888005-A1 NOVEL AZABENZIMIDAZOLE HEXAHYDROFURO[3,2-B]FURAN DERIVATIVES Merck Sharp & Dohme Corp. (US) 2015-07-01 EP disclosed
EP-2887807-A1 NOVEL BENZIMIDAZOLE HEXAHYDROFURO[3,2-B]FURAN DERIVATIVES Merck Sharp & Dohme Corp. (US) 2015-07-01 EP disclosed
EP-2888008-A1 NOVEL AZABENZIMIDAZOLE TETRAHYDROFURAN DERIVATIVES Merck Sharp & Dohme Corp. (US) 2015-07-01 EP disclosed
EP-2888006-A1 NOVEL AZABENZIMIDAZOLE TETRAHYDROPYRAN DERIVATIVES Merck Sharp & Dohme Corp. (US) 2015-07-01 EP disclosed
WO-2014031517-A1 NOVEL AZABENZIMIDAZOLE TETRAHYDROFURAN DERIVATIVES MERCK SHARP & DOHME CORP. (US) 2014-02-27 WO disclosed
WO-2014031515-A1 NOVEL AZABENZIMIDAZOLE HEXAHYDROFURO[3,2-B]FURAN DERIVATIVES MERCK SHARP & DOHME CORP. (US) 2014-02-27 WO disclosed
WO-2014031445-A1 NOVEL BENZIMIDAZOLE TETRAHYDROPYRAN DERIVATIVES MERCK SHARP & DOHME CORP. (US) 2014-02-27 WO disclosed
EP-1534074-A4 COMBINATION THERAPY FOR THE TREATMENT OF OBESITY MERCK & CO INC (US) 2008-01-09 EP disclosed
EP-1558252-A4 SUBSTITUTED FURO 2,3-B| PYRIDINE DERIVATIVES MERCK & CO INC (US) 2006-05-17 EP disclosed
EP-1558252-A2 SUBSTITUTED FURO 2,3-B] PYRIDINE DERIVATIVES Merck & Co., Inc. (US) 2005-08-03 EP disclosed
EP-1534074-A2 COMBINATION THERAPY FOR THE TREATMENT OF OBESITY Merck & Co., Inc. (US) 2005-06-01 EP disclosed
EP-1492784-A2 SUBSTITUTED 2,3-DIPHENYL PYRIDINES Merck & Co., Inc. (US) 2005-01-05 EP disclosed
WO-2004012671-A2 SUBSTITUTED FURO [2,3-B] PYRIDINE DERIVATIVES MERCK & CO., INC. (US) 2004-02-12 WO disclosed
WO-2004009015-A2 COMBINATION THERAPY FOR THE TREATMENT OF OBESITY MERCK & CO., INC. (US) 2004-01-29 WO disclosed
WO-2003082191-A2 SUBSTITUTED 2,3-DIPHENYL PYRIDINES MERCK & CO., INC. (US) 2003-10-09 WO disclosed
WO-2003063781-A2 SUBSTITUTED IMIDAZOLES AS CANNABINOID RECEPTOR MODULATORS MERCK & CO., INC. (US) 2003-08-07 WO disclosed