SCHEMBL13034385

SCHEMBL13034385

C#CCCOC(=O)N1C2CCC1CC(C)C2

nearest known ligand 0.37

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CHRM1 P11229 17/20 0.37
CHRM2 P08172 1/20 0.36
CHRM3 P20309 1/20 0.36
CHRM4 P08173 1/20 0.33
CHRM5 P08912 1/20 0.33
GPR119 Q8TDV5 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31

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
SCHEMBL12086313 0.85 CHRM1 (0.38) CHRM1CHRM2CHRM3CHRM4CHRM5
SCHEMBL12199300 0.84 CHRM1 (0.35) CHRM1CHRM2CHRM3CHRM4CHRM5
SCHEMBL12084285 0.84 CHRM1 (0.40) CHRM1CHRM2CHRM3CHRM4CHRM5
SCHEMBL12199020 0.81 CHRM1 (0.43) CHRM1CHRM2CHRM3CHRM4CHRM5
SCHEMBL1712982 0.80 MEN1 (0.35) CHRM1MEN1KMT2A
SCHEMBL12199103 0.80 CHRM1 (0.39) CHRM1CHRM2CHRM3CHRM4CHRM5
SCHEMBL12198958 0.80 CHRM1 (0.39) CHRM1CHRM2CHRM3CHRM4CHRM5
SCHEMBL12131805 0.79 CHRM1 (0.52) CHRM1CHRM2CHRM3CHRM4CHRM5
SCHEMBL8259202 0.78 LMNA (0.43) CHRM1CHRM2CHRM3CHRM4CHRM5
SCHEMBL13035354 0.75 GAA (0.45) CHRM1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130281476-A1 Modulators of Muscarinic Receptors VERTEX PHARMACEUTICALS INCORPORATED 2013-10-24 US disclosed
US-8497295-B2 Spiroindoline modulators of muscarinic receptors VERTEX PHARMACEUTICALS INCORPORATED (US) 2013-07-30 US disclosed
US-7858635-B2 Spiro compounds as modulators of muscarinic receptors VERTEX PHARMACEUTICALS INCORPORATED (US) 2010-12-28 US disclosed
US-20080015179-A1 Modulators of muscarinic receptors VERTEX PHARMACEUTICALS INCORPORATED 2008-01-17 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 (2 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-20130281476-A1 Modulators of Muscarinic Receptors CHRM3, CHRM5, CHRM2 CHRM1 6/4885CHRM2 3/4885CHRM3 1/4885
US-20080015179-A1 Modulators of muscarinic receptors CHRM3, CHRM5, CHRM2 CHRM1 6/4885CHRM2 3/4885CHRM3 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.