SCHEMBL5568641

SCHEMBL5568641

COc1ccc2ccn(C(=O)NCCN3CCC(COc4ccccc4)CC3)c2c1

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CARM1 Q86X55 1/20 0.52
PRMT6 Q96LA8 1/20 0.52
MTNR1A P48039 4/20 0.48
MTNR1B P49286 4/20 0.48
SLC6A2 P23975 1/20 0.47
SLC6A4 P31645 1/20 0.47
ACHE P22303 2/20 0.45
CCR3 P51677 2/20 0.44
HTR2A P28223 1/20 0.43
POLB P06746 1/20 0.43
TFPI2 P48307 1/20 0.43
FAAH O00519 1/20 0.43
CHRNA7 P36544 2/20 0.43
CHRM4 P08173 1/20 0.42
DRD4 P21917 1/20 0.42

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
SCHEMBL5568390 0.93 CARM1 (0.52) CARM1PRMT6MTNR1AMTNR1BSLC6A2
SCHEMBL5563458 0.89 CARM1 (0.52) CARM1PRMT6TFPI2CHRNA7DRD4
SCHEMBL5569059 0.88 CARM1 (0.50) CARM1PRMT6SLC6A2ACHEFAAH
SCHEMBL5564099 0.88 CARM1 (0.50) CARM1PRMT6CHRNA7
SCHEMBL5563887 0.88 CARM1 (0.56) CARM1PRMT6MTNR1AMTNR1BSLC6A2
SCHEMBL6296170 0.85 CARM1 (0.49) CARM1PRMT6SLC6A2SLC6A4CCR3
SCHEMBL5569587 0.85 CHRNA7 (0.49) MTNR1AMTNR1BCCR3HTR2ACHRNA7
SCHEMBL5568882 0.84 CHRNA7 (0.45) CARM1PRMT6CHRNA7
SCHEMBL5568935 0.84 CARM1 (0.51) CARM1PRMT6SLC6A2CCR3CHRNA7
SCHEMBL5565428 0.83 CARM1 (0.50) CARM1PRMT6SLC6A2ACHEFAAH

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 9 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-6780868-B2 TREATMENT OF MYOCARDIAL OR PERIPHERAL ISCHAEMIA, CARDIAC INSUFFICIENCY OR PULMONARY ARTERIAL HYPERTENSION LES LABORATOIRES SERVIER (FR) 2004-08-24 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-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 (3 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 CARM1 2144/4885PRMT6 1042/4885MTNR1A 2556/4885
US-20030191132-A1 New linear cyclic ureas GUCY1B1, UACA, GUCY1A1 CARM1 2209/4885PRMT6 1136/4885MTNR1A 2619/4885
US-20030225105-A1 New linear cyclic ureas GUCY1B1, UACA, GUCY1A1 CARM1 2209/4885PRMT6 1136/4885MTNR1A 2619/4885

“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.