SCHEMBL2191074

SCHEMBL2191074

CCOC(=O)N1C2CCC1CC(O)C2

nearest known ligand 0.61

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CHRM1 P11229 19/20 0.61
CHRM2 P08172 1/20 0.61
CHRM3 P20309 1/20 0.61
CHRM4 P08173 2/20 0.46
CHRM5 P08912 1/20 0.46
LMNA P02545 1/20 0.43
CYP2C9 P11712 1/20 0.43
KCNH2 Q12809 1/20 0.41

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
SCHEMBL5634834 0.93 CHRM1 (0.53) CHRM1CHRM2CHRM3CHRM4CHRM5
SCHEMBL14145633 0.87 CHRM1 (0.56) CHRM1CHRM2CHRM3CHRM4CHRM5
SCHEMBL12131805 0.85 CHRM1 (0.52) CHRM1CHRM2CHRM3CHRM4CHRM5
SCHEMBL3003076 0.83 CHRM1 (0.52) CHRM1CHRM2CHRM3CHRM4CHRM5
SCHEMBL1574138 0.83 CHRM1 (0.48) CHRM1CHRM2CHRM3CHRM4CHRM5
SCHEMBL1116676 0.83 CHRM1 (0.48) CHRM1CHRM2CHRM3CHRM4CHRM5
SCHEMBL12086312 0.83 CHRM1 (0.48) CHRM1CHRM2CHRM3CHRM4CHRM5
SCHEMBL1116674 0.83 CHRM1 (0.48) CHRM1CHRM2CHRM3CHRM4CHRM5
SCHEMBL15202971 0.83 CHRM1 (0.48) CHRM1CHRM2CHRM3CHRM4CHRM5
SCHEMBL1338719 0.83 CHRM1 (0.48) CHRM1CHRM2CHRM3CHRM4CHRM5

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 17 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7994323-B2 Chromen-2-one derivatives NEUROSEARCH A/S (DK) 2011-08-09 US claimed
EP-2158200-B1 NOVEL CHROMEN-2-ONE DERIVATIVES NEUROSEARCH AS (DK) 2011-07-13 EP claimed
US-20100217002-A1 NOVEL CHROMEN-2-ONE DERIVATIVES NEUROSEARCH A/S (DK) 2010-08-26 US claimed
EP-2158200-A1 NOVEL CHROMEN-2-ONE DERIVATIVES NeuroSearch A/S (DK) 2010-03-03 EP claimed
WO-2008138854-A1 NOVEL CHROMEN-2-ONE DERIVATIVES NEUROSEARCH A/S (DK) 2008-11-20 WO claimed
US-8697691-B2 Alkyl 3-((2-amidoethyl)amino)-8-azabicyclo[3.2.1]octane-8-carboxylate analogs as selective M1 agonists and methods of making and using same VANDERBILT UNIVERSITY (US) 2014-04-15 US disclosed
US-8697691-B2 Alkyl 3-((2-amidoethyl)amino)-8-azabicyclo[3.2.1]octane-8-carboxylate analogs as selective M1 agonists and methods of making and using same VANDERBILT UNIVERSITY (US) 2014-04-15 US disclosed
US-7994323-B2 Chromen-2-one derivatives NEUROSEARCH A/S (DK) 2011-08-09 US disclosed
WO-2011087812-A1 ALKYL 3-((2-AMIDOETHYL)AMINO)-8-AZABICYCLO[3.2.1]OCTANE-8-CARBOXYLATE ANALOGS AS SELECTIVE M1 AGONISTS AND METHODS OF MAKING AND USING SAME VANDERBILT UNIVERSITY (US) 2011-07-21 WO disclosed
US-20110172227-A1 ALKYL 3-((2-AMIDOETHYL)AMINO)-8-AZABICYCLO[3.2.1]OCTANE-8-CARBOXYLATE ANALOGS AS SELECTIVE M1 AGONISTS AND METHODS OF MAKING AND USING SAME VANDERBILT UNIVERSITY 2011-07-14 US disclosed
US-20110172227-A1 ALKYL 3-((2-AMIDOETHYL)AMINO)-8-AZABICYCLO[3.2.1]OCTANE-8-CARBOXYLATE ANALOGS AS SELECTIVE M1 AGONISTS AND METHODS OF MAKING AND USING SAME VANDERBILT UNIVERSITY 2011-07-14 US disclosed
EP-2158200-B1 NOVEL CHROMEN-2-ONE DERIVATIVES NEUROSEARCH AS (DK) 2011-07-13 EP disclosed
US-20100217002-A1 NOVEL CHROMEN-2-ONE DERIVATIVES NEUROSEARCH A/S (DK) 2010-08-26 US disclosed
EP-2158200-A1 NOVEL CHROMEN-2-ONE DERIVATIVES NeuroSearch A/S (DK) 2010-03-03 EP disclosed
WO-2008138854-A1 NOVEL CHROMEN-2-ONE DERIVATIVES NEUROSEARCH A/S (DK) 2008-11-20 WO disclosed
US-6921821-B2 Antagonists of melanin concentrating hormone receptor ABBOTT LABORATORIES (US) 2005-07-26 US disclosed
US-20040106645-A1 Antagonists of melanin concentrating hormone receptor MILLENNIUM PHARMACEUTICALS, INC. 2004-06-03 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 (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-20040106645-A1 Antagonists of melanin concentrating hormone receptor MCHR1, MCHR2, MC1R CHRM1 125/4885CHRM2 344/4885CHRM3 214/4885
US-20110172227-A1 ALKYL 3-((2-AMIDOETHYL)AMINO)-8-AZABICYCLO[3.2.1]OCTANE-8-CARBOXYLATE ANALOGS AS SELECTIVE M1 AGONISTS AND METHODS OF MAKING AND USING SAME CHRM1, CHRM2, CHRM5 CHRM1 1/4885CHRM2 2/4885CHRM3 5/4885
US-20100217002-A1 NOVEL CHROMEN-2-ONE DERIVATIVES CBX2, CYP2J2, CDYL2 CHRM1 630/4885CHRM2 677/4885CHRM3 606/4885

“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.