SCHEMBL3009474

SCHEMBL3009474

COCCOC1CCC(C)(N2CCC(Nc3cc(COC)ccc3O)CC2)CC1

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CHRM4 P08173 8/20 0.43
CHRM5 P08912 8/20 0.43
CHRM1 P11229 8/20 0.43
CHRM2 P08172 7/20 0.43
CHRM3 P20309 7/20 0.43
CHRNA7 P36544 1/20 0.36
OPRM1 P35372 4/20 0.35
CCR5 P51681 5/20 0.33
CD38 P28907 2/20 0.33

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
SCHEMBL3009471 1.00 CHRM4 (0.43) CHRM4CHRM5CHRM1CHRM2CHRM3
SCHEMBL3017501 0.88 CHRM2 (0.53) CHRM4CHRM5CHRM1CHRM2CHRM3
SCHEMBL3017504 0.88 CHRM2 (0.53) CHRM4CHRM5CHRM1CHRM2CHRM3
SCHEMBL3010071 0.87 CHRM2 (0.44) CHRM4CHRM5CHRM1CHRM2CHRM3
SCHEMBL3010077 0.87 CHRM2 (0.44) CHRM4CHRM5CHRM1CHRM2CHRM3
SCHEMBL13236005 0.86 CHRNA7 (0.38) CHRNA7OPRM1CCR5
SCHEMBL3005436 0.85 CHRM2 (0.56) CHRM4CHRM5CHRM1CHRM2CHRM3
SCHEMBL3019835 0.85 CHRM2 (0.44) CHRM4CHRM5CHRM1CHRM2CHRM3
SCHEMBL3005709 0.85 CHRM2 (0.42) CHRM4CHRM5CHRM1CHRM2CHRM3
SCHEMBL3005429 0.85 CHRM2 (0.56) CHRM4CHRM5CHRM1CHRM2CHRM3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8426443-B2 Compounds which have activity at M1 receptor and their uses in medicine GLAXO GROUP LIMITED (GB) 2013-04-23 US disclosed
US-20120316196-A1 Compounds Which Have Activity at M1 Receptor and Their Uses in Medicine GLAXO GROUP LIMITED (GB) 2012-12-13 US disclosed
US-8299257-B2 Compounds which have activity at M1receptor and their uses in medicine GLAXO GROUP LIMITED (GB) 2012-10-30 US disclosed
US-8278328-B2 Compounds which have activity at M1 receptor and their uses in medicine GLAXO GROUP LIMITED (GB) 2012-10-02 US disclosed
US-20100210687-A1 Compounds which have activity at M1 receptor and their uses in medicine GLAXO GROUP LIMITED (GB) 2010-08-19 US disclosed
US-20100204272-A1 Compounds which have activity at M1 receptor and their uses in medicine Glaxo Group Limited a corporation 2010-08-12 US disclosed
EP-2194982-A1 COMPOUNDS WHICH HAVE ACTIVITY AT M1 RECEPTOR AND THEIR USES IN MEDICINE Glaxo Group Limited (GB) 2010-06-16 EP disclosed
EP-2194983-A1 COMPOUNDS WHICH HAVE ACTIVITY AT M1 RECEPTOR AND THEIR USES IN MEDICINE Glaxo Group Limited (GB) 2010-06-16 EP disclosed
WO-2009037294-A1 COMPOUNDS WHICH HAVE ACTIVITY AT M1 RECEPTOR AND THEIR USES IN MEDICINE GLAXO GROUP LIMITED (GB) 2009-03-26 WO disclosed
WO-2009037296-A1 COMPOUNDS WHICH HAVE ACTIVITY AT M1 RECEPTOR AND THEIR USES IN MEDICINE GLAXO GROUP LIMITED (GB) 2009-03-26 WO 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-20100210687-A1 Compounds which have activity at M1 receptor and their uses in medicine CHRM1, CHRM2, CHRM5 CHRM4 4/4885CHRM5 3/4885CHRM1 1/4885
US-20100204272-A1 Compounds which have activity at M1 receptor and their uses in medicine CHRM1, CHRM2, CHRM5 CHRM4 4/4885CHRM5 3/4885CHRM1 1/4885
US-20120316196-A1 Compounds Which Have Activity at M1 Receptor and Their Uses in Medicine CHRM1, CHRM2, CHRM5 CHRM4 4/4885CHRM5 3/4885CHRM1 1/4885

“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.