SCHEMBL13060209

SCHEMBL13060209

CCC1CC2CCC(C1)N2C(=O)OCC(F)F

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CHRM1 P11229 19/20 0.40
CHRM2 P08172 2/20 0.36
CHRM3 P20309 2/20 0.36
CHRM4 P08173 3/20 0.35
CHRM5 P08912 1/20 0.35
KCNH2 Q12809 1/20 0.34
HCRTR2 O43614 1/20 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
SCHEMBL12086284 0.86 RAB9A (0.42) CHRM1CHRM2CHRM3CHRM4CHRM5
SCHEMBL12198759 0.84 CHRM1 (0.39) CHRM1CHRM2CHRM3CHRM4CHRM5
SCHEMBL12086312 0.84 CHRM1 (0.48) CHRM1CHRM2CHRM3CHRM4CHRM5
SCHEMBL12988771 0.82 CHRM1 (0.37) CHRM1CHRM2CHRM3CHRM4CHRM5
SCHEMBL12199273 0.81 CHRM1 (0.42) CHRM1CHRM2CHRM3CHRM4CHRM5
SCHEMBL13058790 0.80 CHRM1 (0.38) CHRM1CHRM2CHRM3CHRM4CHRM5
SCHEMBL12086282 0.80 CHRM1 (0.39) CHRM1CHRM2CHRM3CHRM4CHRM5
SCHEMBL13034555 0.78 GAA (0.33) HCRTR2
SCHEMBL12086290 0.77 CHRM1 (0.42) CHRM1CHRM2CHRM3CHRM4CHRM5
SCHEMBL12086318 0.77 CHRM1 (0.44) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8497295-B2 Spiroindoline modulators of muscarinic receptors VERTEX PHARMACEUTICALS INCORPORATED (US) 2013-07-30 US disclosed
US-20120283243-A1 Spiroindoline Modulators of Muscarinic Receptors VERTEX PHARMACEUTICALS INCORPORATED (US) 2012-11-08 US disclosed
US-20100311720-A1 Spiroindoline Modulators of Muscarinic Receptors VERTEX PHARMACEUTICALS INCORPORATED (US) 2010-12-09 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-20100311720-A1 Spiroindoline Modulators of Muscarinic Receptors CHRM3, CHRM2, CHRM4 CHRM1 9/4885CHRM2 2/4885CHRM3 1/4885
US-20120283243-A1 Spiroindoline Modulators of Muscarinic Receptors CHRM3, CHRM2, CHRM5 CHRM1 6/4885CHRM2 2/4885CHRM3 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.