SCHEMBL20438228

SCHEMBL20438228

CC(=O)C1CN(CC2CCC2)C1

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 1/20 0.42
▸ GBA1 P04062 1/20 0.40
▸ KDM2B Q8NHM5 14/20 0.39
▸ CHRM5 P08912 1/20 0.39
▸ ADRA2C P18825 1/20 0.39
▸ ACHE P22303 1/20 0.38
▸ SCN1A P35498 1/20 0.37
▸ SCN4A P35499 1/20 0.37
▸ SCN7A Q01118 1/20 0.37
▸ KCNH2 Q12809 1/20 0.37
▸ SCN5A Q14524 1/20 0.37
▸ SCN9A Q15858 1/20 0.37
▸ SCN2A Q99250 1/20 0.37
▸ SCN3A Q9NY46 1/20 0.37
▸ SCN11A Q9UI33 1/20 0.37
▸ SCN8A Q9UQD0 1/20 0.37
▸ SCN10A Q9Y5Y9 1/20 0.37

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
SCHEMBL22358960 0.83 GBA1 (0.49) GBA1KDM2BACHE
SCHEMBL24003650 0.82 KDM2B (0.35) SMN1; SMN2KDM2B
SCHEMBL17873962 0.82 SMN1; SMN2 (0.43) SMN1; SMN2GBA1KDM2BCHRM5ADRA2C
SCHEMBL13905846 0.78 SMN1; SMN2 (0.47) SMN1; SMN2GBA1KDM2BCHRM5ADRA2C
SCHEMBL25728779 0.77 SMN1; SMN2 (0.37) SMN1; SMN2GBA1KDM2BCHRM5ADRA2C
SCHEMBL27274598 0.76 CHRM5 (0.43) SMN1; SMN2GBA1KDM2BCHRM5ADRA2C
SCHEMBL13905729 0.76 SMN1; SMN2 (0.50) SMN1; SMN2GBA1KDM2BCHRM5ADRA2C
SCHEMBL13136048 0.73 SMN1; SMN2 (0.51) SMN1; SMN2CHRM5ADRA2CACHE
SCHEMBL4678458 0.72 PLG (0.45) SMN1; SMN2KDM2BSCN1ASCN4ASCN7A
SCHEMBL25512557 0.72 SMN1; SMN2 (0.50) SMN1; SMN2ACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180214419-A1 COMPOUNDS, COMPOSITIONS, AND METHODS OF INCREASING CFTR ACTIVITY PROTEOSTASIS THERAPEUTICS, INC. 2018-08-02 — — 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-20180214419-A1 COMPOUNDS, COMPOSITIONS, AND METHODS OF INCREASING CFTR ACTIVITY CFTR, ABCB4, SCNN1B SMN1; SMN2 3701/4885GBA1 83/4885KDM2B 4824/4885

“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.

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