SCHEMBL4636552

SCHEMBL4636552

CCc1ccc2[nH]c(=O)n(C3CCN(C4CCOCC4)CC3)c2c1

nearest known ligand 0.74

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CHRM1 P11229 14/20 0.74
CHRM2 P08172 6/20 0.74
CHRM4 P08173 6/20 0.74
CHRM3 P20309 5/20 0.74
CHRM5 P08912 4/20 0.74
KCNH2 Q12809 2/20 0.74
OPRM1 P35372 4/20 0.48
OPRD1 P41143 1/20 0.48
OPRK1 P41145 1/20 0.48
OPRL1 P41146 1/20 0.48
DRD2 P14416 3/20 0.47
ADRA1D P25100 1/20 0.47
HTR2C P28335 1/20 0.47
ADRA1A P35348 1/20 0.47
ADRA1B P35368 1/20 0.47
CYP2D6 P10635 1/20 0.44
CYP2C9 P11712 1/20 0.44

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
Hydrochloric Acid SCHEMBL4636354 0.99 CHRM1 (0.72) CHRM1CHRM2CHRM4CHRM3CHRM5
SCHEMBL603377 0.86 CHRM1 (0.54) CHRM1CHRM2CHRM4CHRM3CHRM5
SCHEMBL603378 0.86 CHRM1 (0.54) CHRM1CHRM2CHRM4CHRM3CHRM5
SCHEMBL4636326 0.85 CHRM1 (1.00) CHRM1CHRM2CHRM4CHRM3CHRM5
Hydrochloric Acid SCHEMBL608248 0.85 CHRM1 (0.53) CHRM1CHRM2CHRM4CHRM3CHRM5
Hydrochloric Acid SCHEMBL608247 0.85 CHRM1 (0.53) CHRM1CHRM2CHRM4CHRM3CHRM5
Hydrochloric Acid SCHEMBL4636433 0.84 CHRM1 (0.98) CHRM1CHRM2CHRM4CHRM3CHRM5
SCHEMBL17758364 0.84 CHRM1 (0.77) CHRM1CHRM2CHRM4CHRM3CHRM5
SCHEMBL607448 0.83 CHRM1 (0.52) CHRM1CHRM2CHRM4CHRM3CHRM5
SCHEMBL607447 0.83 CHRM1 (0.52) CHRM1CHRM2CHRM4CHRM3CHRM5

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
US-8288413-B2 Benzimidazolones which have activity at M1 receptor GLAXO GROUP LIMITED (GB) 2012-10-16 US claimed
US-20080306112-A1 Benzimidazolones Which Have Activity at M1 Receptor GLAXO GROUP LIMITED (GB) 2008-12-11 US claimed
US-8288413-B2 Benzimidazolones which have activity at M1 receptor GLAXO GROUP LIMITED (GB) 2012-10-16 US disclosed
US-8288413-B2 Benzimidazolones which have activity at M1 receptor GLAXO GROUP LIMITED (GB) 2012-10-16 US disclosed
US-8288413-B2 Benzimidazolones which have activity at M1 receptor GLAXO GROUP LIMITED (GB) 2012-10-16 US disclosed
US-20080306112-A1 Benzimidazolones Which Have Activity at M1 Receptor GLAXO GROUP LIMITED (GB) 2008-12-11 US disclosed
US-20080306112-A1 Benzimidazolones Which Have Activity at M1 Receptor GLAXO GROUP LIMITED (GB) 2008-12-11 US disclosed
US-20080306112-A1 Benzimidazolones Which Have Activity at M1 Receptor GLAXO GROUP LIMITED (GB) 2008-12-11 US disclosed
EP-1937670-A1 BENZIMIDAZOLONES WHICH HAVE ACTIVITY AT M1 RECEPTOR GLAXO GROUP LIMITED (GB) 2008-07-02 EP disclosed
WO-2007036711-A1 BENZIMIDAZOLONES WHICH HAVE ACTIVITY AT Ml RECEPTOR GLAXO GROUP LIMITED (GB) 2007-04-05 WO disclosed
WO-2007036711-A1 BENZIMIDAZOLONES WHICH HAVE ACTIVITY AT Ml RECEPTOR GLAXO GROUP LIMITED (GB) 2007-04-05 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 (1 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-20080306112-A1 Benzimidazolones Which Have Activity at M1 Receptor CHRM1, CHRM2, CHRM4 CHRM1 1/4885CHRM2 2/4885CHRM4 3/4885

“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.