SCHEMBL19992910

SCHEMBL19992910

CN1CC2CC1CN2CC(=O)O

nearest known ligand 0.46

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 3/20 0.33
SLC6A9 P48067 3/20 0.33
CHRM2 P08172 4/20 0.32
CHRM4 P08173 4/20 0.32
CHRM5 P08912 4/20 0.32
CHRM1 P11229 4/20 0.32
CHRM3 P20309 4/20 0.32

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
SCHEMBL25131301 0.85 CHRM2 (0.35) HSD11B1CHRM2CHRM4CHRM5CHRM1
SCHEMBL14885141 0.85 SLC6A9 (0.33) SLC6A9
SCHEMBL14885223 0.85 SLC6A9 (0.33) SLC6A9
SCHEMBL31009117 0.83 HSD11B1 (0.33) HSD11B1CHRM2CHRM4CHRM5CHRM1
SCHEMBL30226481 0.83 HSD11B1 (0.33) HSD11B1CHRM2CHRM4CHRM5CHRM1
SCHEMBL31008735 0.83 HSD11B1 (0.33) HSD11B1CHRM2CHRM4CHRM5CHRM1
SCHEMBL20793566 0.82 SLC6A9 (0.33) SLC6A9
SCHEMBL19992816 0.77
SCHEMBL21128451 0.77 SLC6A9 (0.31) SLC6A9
SCHEMBL19992845 0.77 SLC6A9 (0.33) SLC6A9

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
EP-3515897-B1 PIPERAZINE CARBAMATES AS MODULATORS OF MAGL AND/OR ABHD6 AND THEIR USE H LUNDBECK AS (DK) 2021-08-18 EP disclosed
US-20210214375-A1 SPIROCYCLE COMPOUNDS AND METHODS OF MAKING AND USING SAME H. LUNDBECK A/S (DK) 2021-07-15 US disclosed
WO-2019046330-A1 SPIROCYCLE COMPOUNDS AND METHODS OF MAKING AND USING SAME ABIDE THERAPEUTICS, INC. (US) 2019-03-07 WO disclosed
WO-2018053447-A1 PIPERAZINE CARBAMATES AND METHODS OF MAKING AND USING SAME ABIDE THERAPEUTICS, INC. (US) 2018-03-22 WO 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-20210214375-A1 SPIROCYCLE COMPOUNDS AND METHODS OF MAKING AND USING SAME OPRL1, MGLL, OPRK1 HSD11B1 718/4885SLC6A9 3538/4885CHRM2 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.