SCHEMBL301711

SCHEMBL301711

COc1cc2c(cc1OC)CCN(C(=O)CCN(C)C[C@H]1Cc3cc(OC)c(OC)cc31)CC2

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 1/20 0.62
HTR1A P08908 1/20 0.62
SLC6A4 P31645 1/20 0.62
DRD3 P35462 1/20 0.62
KCNH2 Q12809 1/20 0.62
HCN4 Q9Y3Q4 1/20 0.62
KMT2A Q03164 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.44
RAB9A P51151 1/20 0.44
NPC1 O15118 1/20 0.42
ALDH1A1 P00352 3/20 0.42
NPSR1 Q6W5P4 2/20 0.41
MAPT P10636 1/20 0.41
HPGD P15428 1/20 0.41
HTT P42858 1/20 0.41
KDM4E B2RXH2 3/20 0.41
LMNA P02545 1/20 0.41
TP53 P04637 1/20 0.41
HSD17B10 Q99714 1/20 0.41
ABCB1 P08183 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
SCHEMBL3154423 1.00 CHRM2 (0.62) CHRM2HTR1ASLC6A4DRD3KCNH2
Hydrochloric Acid SCHEMBL4246608 0.99 CHRM2 (0.61) CHRM2HTR1ASLC6A4DRD3KCNH2
Hydrochloric Acid SCHEMBL4244379 0.99 CHRM2 (0.61) CHRM2HTR1ASLC6A4DRD3KCNH2
Hydrochloric Acid SCHEMBL4246589 0.99 CHRM2 (0.61) CHRM2HTR1ASLC6A4DRD3KCNH2
SCHEMBL17120954 0.95 DRD3 (0.57) CHRM2HTR1ASLC6A4DRD3KCNH2
SCHEMBL3162438 0.95 CHRM2 (0.60) CHRM2HTR1ASLC6A4DRD3KCNH2
Hydrochloric Acid SCHEMBL4249169 0.94 CHRM2 (0.59) CHRM2HTR1ASLC6A4DRD3KCNH2
SCHEMBL3438788 0.94 HTR1A (0.56) CHRM2HTR1ASLC6A4DRD3KCNH2
Fumaric Acid SCHEMBL4245791 0.94 CHRM2 (0.56) CHRM2HTR1ASLC6A4DRD3KCNH2
Fumaric Acid SCHEMBL4245795 0.94 CHRM2 (0.56) CHRM2HTR1ASLC6A4DRD3KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2921168-B1 ASSOCIATION OF N-{[(7S)-3,4-DIMETHOXYBICYCLO[4.2.0]OCTA-1,3,5-TRIEN-7-YL]METHYL}-3-(7,8-DIMETHOXY-1,2,4,5-TETRAHYDRO-3H-3-BENZAZEPIN-3-YL)-N-METHYL-3-OXO-1-PROPANAMINE AND PERINDOPRIL SERVIER LAB (FR) 2016-04-13 EP claimed
EP-2921168-A1 USE OF THE COMBINATION OF A SINUS CURRENT IF INHIBITOR AND AN INHIBITOR OF THE ANGIOTENSIN CONVERSION ENZYME FOR TREATING CARDIAC INSUFFICIENCY Les Laboratoires Servier (FR) 2015-09-23 EP claimed
EP-2404600-B1 Use of the combination of a sinus current If inhibitor and an inhibitor of the angiotensin conversion enzyme for treating cardiac insufficiency with preserved systolic function SERVIER LAB (FR) 2015-05-27 EP claimed
EP-2404600-A1 Use of the combination of a sinus current If inhibitor and an inhibitor of the angiotensin conversion enzyme for treating cardiac insufficiency Les Laboratoires Servier (FR) 2012-01-11 EP claimed
WO-2011157908-A1 USE OF THE COMBINATION OF AN INHIBITOR OF THE IF CURRENT OF THE SINOATRIAL NODE AND AN INHIBITOR OF THE ANGIOTENSIN-CONVERTING ENZYME FOR TREATING HEART FAILURE LES LABORATOIRES SERVIER (FR) 2011-12-22 WO claimed
US-20110306598-A1 Use of the association of a sinus node if current inhibitor and an angiotensin-converting enzyme inhibitor in the treatment of heart failure LES LABORATOIRES SERVIER (FR) 2011-12-15 US claimed
EP-2921168-B1 ASSOCIATION OF N-{[(7S)-3,4-DIMETHOXYBICYCLO[4.2.0]OCTA-1,3,5-TRIEN-7-YL]METHYL}-3-(7,8-DIMETHOXY-1,2,4,5-TETRAHYDRO-3H-3-BENZAZEPIN-3-YL)-N-METHYL-3-OXO-1-PROPANAMINE AND PERINDOPRIL SERVIER LAB (FR) 2016-04-13 EP disclosed
EP-2921168-B1 ASSOCIATION OF N-{[(7S)-3,4-DIMETHOXYBICYCLO[4.2.0]OCTA-1,3,5-TRIEN-7-YL]METHYL}-3-(7,8-DIMETHOXY-1,2,4,5-TETRAHYDRO-3H-3-BENZAZEPIN-3-YL)-N-METHYL-3-OXO-1-PROPANAMINE AND PERINDOPRIL SERVIER LAB (FR) 2016-04-13 EP disclosed
EP-2921168-B1 ASSOCIATION OF N-{[(7S)-3,4-DIMETHOXYBICYCLO[4.2.0]OCTA-1,3,5-TRIEN-7-YL]METHYL}-3-(7,8-DIMETHOXY-1,2,4,5-TETRAHYDRO-3H-3-BENZAZEPIN-3-YL)-N-METHYL-3-OXO-1-PROPANAMINE AND PERINDOPRIL SERVIER LAB (FR) 2016-04-13 EP disclosed
EP-2921168-A1 USE OF THE COMBINATION OF A SINUS CURRENT IF INHIBITOR AND AN INHIBITOR OF THE ANGIOTENSIN CONVERSION ENZYME FOR TREATING CARDIAC INSUFFICIENCY Les Laboratoires Servier (FR) 2015-09-23 EP disclosed
EP-2921168-A1 USE OF THE COMBINATION OF A SINUS CURRENT IF INHIBITOR AND AN INHIBITOR OF THE ANGIOTENSIN CONVERSION ENZYME FOR TREATING CARDIAC INSUFFICIENCY Les Laboratoires Servier (FR) 2015-09-23 EP disclosed
CN-104906579-A Use of the association of a sinus node If current inhibitor and an angiotensin-converting enzyme inhibitor in the treatment of heart failure SERVIER LAB 2015-09-16 CN disclosed
EP-2404600-B1 Use of the combination of a sinus current If inhibitor and an inhibitor of the angiotensin conversion enzyme for treating cardiac insufficiency with preserved systolic function SERVIER LAB (FR) 2015-05-27 EP disclosed
WO-2011157908-A1 USE OF THE COMBINATION OF AN INHIBITOR OF THE IF CURRENT OF THE SINOATRIAL NODE AND AN INHIBITOR OF THE ANGIOTENSIN-CONVERTING ENZYME FOR TREATING HEART FAILURE LES LABORATOIRES SERVIER (FR) 2011-12-22 WO disclosed
WO-2011157908-A1 USE OF THE COMBINATION OF AN INHIBITOR OF THE IF CURRENT OF THE SINOATRIAL NODE AND AN INHIBITOR OF THE ANGIOTENSIN-CONVERTING ENZYME FOR TREATING HEART FAILURE LES LABORATOIRES SERVIER (FR) 2011-12-22 WO disclosed
CN-102284060-A Sinus node IfUse of a combination of a current inhibitor and an angiotensin converting enzyme inhibitor for the treatment of heart failure 2011-12-21 CN disclosed
US-20110306598-A1 Use of the association of a sinus node if current inhibitor and an angiotensin-converting enzyme inhibitor in the treatment of heart failure LES LABORATOIRES SERVIER (FR) 2011-12-15 US disclosed
US-20110306598-A1 Use of the association of a sinus node if current inhibitor and an angiotensin-converting enzyme inhibitor in the treatment of heart failure LES LABORATOIRES SERVIER (FR) 2011-12-15 US disclosed
US-8076325-B2 1,2,4,5-tetrahydro-3H-benzazepine compounds, a process for their preparation and pharmaceutical compositions containing them LES LABORATOIRES SERVIER (FR) 2011-12-13 US disclosed
US-20090069296-A1 1,2,4,5-Tetrahydro-3H-benzazepine compounds, a process for their preparation and pharmaceutical compositions containing them LES LABORATOIRES SERVIER (FR) 2009-03-12 US 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 (2 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-20110306598-A1 Use of the association of a sinus node if current inhibitor and an angiotensin-converting enzyme inhibitor in the treatment of heart failure ACE, KCNN4, AGTR1 CHRM2 412/4885HTR1A 447/4885SLC6A4 1502/4885
US-20090069296-A1 1,2,4,5-Tetrahydro-3H-benzazepine compounds, a process for their preparation and pharmaceutical compositions containing them OXER1, NR1H3, OXSR1 CHRM2 72/4885HTR1A 61/4885SLC6A4 902/4885

“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.