SCHEMBL5569217

SCHEMBL5569217

NC1CCN(CCCc2coc3ccccc23)CC1

nearest known ligand 0.51

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 2/20 0.48
DRD2 P14416 2/20 0.48
HTR1A P08908 4/20 0.43
SIGMAR1 Q99720 4/20 0.43
HTR1D P28221 1/20 0.42
HTR1B P28222 1/20 0.42
SPHK1 Q9NYA1 1/20 0.39
CHRNB2 P17787 1/20 0.39
CHRNA4 P43681 1/20 0.39
HTR2A P28223 1/20 0.39
DRD3 P35462 1/20 0.39

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
SCHEMBL5564087 0.92 DRD2 (0.50) SLC6A4DRD2HTR1ASIGMAR1SPHK1
SCHEMBL5345674 0.87 DRD2 (0.51) SLC6A4DRD2SIGMAR1
SCHEMBL5335268 0.85 DRD2 (0.52) SLC6A4DRD2HTR1ASIGMAR1CHRNB2
SCHEMBL6215084 0.83 SIGMAR1 (0.55) SLC6A4DRD2HTR1ASIGMAR1HTR2A
SCHEMBL5332520 0.83 DRD2 (0.53) SLC6A4DRD2HTR1ASIGMAR1HTR2A
SCHEMBL5334230 0.82 DRD2 (0.52) SLC6A4DRD2HTR1ASIGMAR1HTR2A
SCHEMBL6300929 0.81 SIGMAR1 (0.54) SLC6A4DRD2HTR1ASIGMAR1HTR1D
SCHEMBL6214207 0.79 HTR1A (0.48) SLC6A4DRD2HTR1ASIGMAR1HTR2A
SCHEMBL6301070 0.77 DRD2 (0.45) SLC6A4DRD2HTR1AHTR2ADRD3
SCHEMBL6217017 0.76 SIGMAR1 (0.41) SLC6A4DRD2HTR1ASIGMAR1DRD3

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-1266896-B1 Linear or cyclic ureas, process for their preparation and pharmaceutical compositions containing them SERVIER LAB (FR) 2007-01-17 EP disclosed
US-6908922-B2 Anticholesterol agents; cardiovascular disorders LES LABORATOIRES SERVIER (FR) 2005-06-21 US disclosed
US-6903103-B2 Linear cyclic ureas LES LABORATORIES SERVIER (FR) 2005-06-07 US disclosed
EP-1122254-B1 4-Sulfonamide piperidine derivatives, method for their preparation and phamaceutical compositions containing them SERVIER LAB (FR) 2005-04-27 EP disclosed
US-6780868-B2 TREATMENT OF MYOCARDIAL OR PERIPHERAL ISCHAEMIA, CARDIAC INSUFFICIENCY OR PULMONARY ARTERIAL HYPERTENSION LES LABORATOIRES SERVIER (FR) 2004-08-24 US disclosed
US-20030229100-A1 New linear cyclic ureas PEGLION JEAN-LOUIS (FR) 2003-12-11 US disclosed
US-20030225105-A1 New linear cyclic ureas PEGLION JEAN-LOUIS (FR) 2003-12-04 US disclosed
US-20030191132-A1 New linear cyclic ureas PEGLION JEAN-LOUIS (FR) 2003-10-09 US disclosed
US-6566364-B2 Isomers, hydrates, solvates and addition salts in treatment of endothelial dysfunction disease such as atherosclerosis, dyslipidaemia; antidiabetic agents; heart transplantation; inhibition of nitrogen monoxide synthase and oxidative stress LES LABORATOIRES SERVIER (FR) 2003-05-20 US disclosed
EP-1266896-A1 Linear ou cyclic ureas, process for their preparation and pharmaceutical compositions containing them Les Laboratoires Servier (FR) 2002-12-18 EP disclosed
US-6323217-B2 CARDIOVASCULAR DISORDERS ADIR ET COMPAGNIE (FR) 2001-11-27 US disclosed
US-20010034352-A1 Piperidine-4 sulphonamide compounds LES LABORATOIRES SERVIER (FR) 2001-10-25 US disclosed
EP-1122254-A2 4-Sulfonamide piperidine derivatives, method for their preparation and phamaceutical compositions containing them ADIR ET COMPAGNIE (FR) 2001-08-08 EP disclosed
US-20010009911-A1 New linear or cyclic ureas LES LABORATOIRES SERVIER (FR) 2001-07-26 US disclosed
EP-1113014-A1 Linear or cyclic ureas, a process for their preparation and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 2001-07-04 EP 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-20010009911-A1 New linear or cyclic ureas GUCY1B1, UACA, LIPG SLC6A4 3681/4885DRD2 3536/4885HTR1A 1343/4885
US-20010034352-A1 Piperidine-4 sulphonamide compounds KDR, GLS, FLT1 SLC6A4 918/4885DRD2 125/4885HTR1A 94/4885
US-20030191132-A1 New linear cyclic ureas GUCY1B1, UACA, GUCY1A1 SLC6A4 4053/4885DRD2 3284/4885HTR1A 1186/4885
US-20030229100-A1 New linear cyclic ureas GUCY1B1, UACA, GUCY1A1 SLC6A4 4053/4885DRD2 3284/4885HTR1A 1186/4885
US-20030225105-A1 New linear cyclic ureas GUCY1B1, UACA, GUCY1A1 SLC6A4 4053/4885DRD2 3284/4885HTR1A 1186/4885

“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.