SCHEMBL5565689

SCHEMBL5565689

NCCN1CCC(CCOc2ccccc2)CC1

nearest known ligand 0.61

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TMEM97 Q5BJF2 2/20 0.59
SIGMAR1 Q99720 2/20 0.59
PRMT3 O60678 1/20 0.57
CARM1 Q86X55 1/20 0.57
PRMT6 Q96LA8 1/20 0.57
PRMT1 Q99873 1/20 0.57
PRMT8 Q9NR22 1/20 0.57
KCNH2 Q12809 1/20 0.55
TEAD1 P28347 1/20 0.53
TEAD3 Q99594 1/20 0.53

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
SCHEMBL27877049 0.88 TMEM97 (0.74) TMEM97SIGMAR1KCNH2TEAD1TEAD3
SCHEMBL27373071 0.87 NFE2L2 (0.61) TMEM97SIGMAR1PRMT3CARM1PRMT6
SCHEMBL5568449 0.86 HTR1A (0.50) KCNH2
SCHEMBL5569842 0.85 CARM1 (0.68) TMEM97SIGMAR1PRMT3CARM1PRMT6
SCHEMBL1333250 0.84 KCNH2 (0.71) TMEM97SIGMAR1KCNH2
SCHEMBL3571383 0.82 TMEM97 (0.71) TMEM97SIGMAR1
SCHEMBL7322566 0.82 TMEM97 (0.61) TMEM97SIGMAR1KCNH2
SCHEMBL1332618 0.81 KCNH2 (0.58) TMEM97SIGMAR1KCNH2
SCHEMBL1307349 0.81 LTA4H (0.63) TMEM97SIGMAR1
SCHEMBL8286318 0.81 TAAR1 (0.57) TEAD1TEAD3

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 11 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
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-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 (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-20010009911-A1 New linear or cyclic ureas GUCY1B1, UACA, LIPG TMEM97 993/4885SIGMAR1 177/4885PRMT3 737/4885
US-20030191132-A1 New linear cyclic ureas GUCY1B1, UACA, GUCY1A1 TMEM97 1321/4885SIGMAR1 382/4885PRMT3 759/4885
US-20030229100-A1 New linear cyclic ureas GUCY1B1, UACA, GUCY1A1 TMEM97 1321/4885SIGMAR1 382/4885PRMT3 759/4885
US-20030225105-A1 New linear cyclic ureas GUCY1B1, UACA, GUCY1A1 TMEM97 1321/4885SIGMAR1 382/4885PRMT3 759/4885

“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.