SCHEMBL21726285

SCHEMBL21726285

O=C1OCC2CCCC[C@]12c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 1/20 0.40
SLC6A4 P31645 1/20 0.40
SLC6A3 Q01959 1/20 0.40
MAPK1 P28482 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
GRIN1 Q05586 2/20 0.38
GRIN2A Q12879 2/20 0.38
CHRM2 P08172 6/20 0.36
CHRM4 P08173 6/20 0.36
CHRM5 P08912 6/20 0.36
CHRM1 P11229 6/20 0.36
CHRM3 P20309 6/20 0.36
ALDH1A1 P00352 1/20 0.36
APP P05067 1/20 0.35
CTSD P07339 1/20 0.35
BACE1 P56817 1/20 0.35
BACE2 Q9Y5Z0 1/20 0.35

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
SCHEMBL18033721 1.00 SLC6A2 (0.40) SLC6A2SLC6A4SLC6A3MAPK1SMN1; SMN2
SCHEMBL13253824 1.00 SLC6A2 (0.40) SLC6A2SLC6A4SLC6A3MAPK1SMN1; SMN2
SCHEMBL3518004 1.00 SLC6A2 (0.40) SLC6A2SLC6A4SLC6A3MAPK1SMN1; SMN2
SCHEMBL20210205 0.79 SLC6A4 (0.47) SLC6A2SLC6A4SLC6A3
SCHEMBL13272953 0.79 SLC6A4 (0.47) SLC6A2SLC6A4SLC6A3
SCHEMBL2469280 0.79 SLC6A4 (0.47) SLC6A2SLC6A4SLC6A3
SCHEMBL20203033 0.79 SLC6A4 (0.47) SLC6A2SLC6A4SLC6A3
SCHEMBL1286642 0.78 MAPK1 (0.40) MAPK1SMN1; SMN2CHRM2CHRM4ALDH1A1
SCHEMBL21153824 0.78 MAPK1 (0.40) MAPK1SMN1; SMN2CHRM2CHRM4ALDH1A1
SCHEMBL4404026 0.78 MAPK1 (0.40) MAPK1SMN1; SMN2CHRM2CHRM4ALDH1A1

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-10562878-B2 Cycloalkylamines as monoamine reuptake inhibitors SUNOVION PHARAMCEUTICALS INC. (US) 2020-02-18 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-10562878-B2 Cycloalkylamines as monoamine reuptake inhibitors SLC18A2, SLC6A2, SLC18A3 SLC6A2 2/4885SLC6A4 5/4885SLC6A3 4/4885

“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.