SCHEMBL10216372

SCHEMBL10216372

CC(C)[C@H]1C[C@@H](CN2CCC2)C1

nearest known ligand 0.41

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CHRM5 P08912 1/20 0.41
ADRA2C P18825 1/20 0.41
ACHE P22303 1/20 0.36
HRH3 Q9Y5N1 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
SCHEMBL25133447 0.82 SMN1; SMN2 (0.38) CHRM5
SCHEMBL10216443 0.82 ACHE (0.37) CHRM5ADRA2CACHE
SCHEMBL10216664 0.81 OPRM1 (0.32) CHRM5ADRA2C
SCHEMBL12014122 0.80 CHRM5 (0.50) CHRM5ADRA2CACHEHRH3
SCHEMBL10217085 0.80 ACHE (0.36) CHRM5ADRA2CACHEHRH3
SCHEMBL10216405 0.80
SCHEMBL10216381 0.79 MEN1 (0.34)
SCHEMBL10216578 0.79 MEN1 (0.34)
SCHEMBL10217445 0.79
SCHEMBL10216453 0.75

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120165310-A1 ETHER DERIVATIVES OF BICYCLIC HETEROARYLS NOVARTIS AG (CH) 2012-06-28 US disclosed
US-20120165310-A1 ETHER DERIVATIVES OF BICYCLIC HETEROARYLS NOVARTIS AG (CH) 2012-06-28 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 (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-20120165310-A1 ETHER DERIVATIVES OF BICYCLIC HETEROARYLS ETV6, CYP11B2, CYP11B1 CHRM5 3318/4885ADRA2C 416/4885ACHE 3968/4885

“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.