SCHEMBL21361602

SCHEMBL21361602

CC(C)N1CCc2c(Cl)cccc2C1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRA2A P08913 2/20 0.57
ADRA2B P18089 2/20 0.57
ADRA2C P18825 2/20 0.57
CYP2D6 P10635 1/20 0.57
ADRA1D P25100 1/20 0.57
ADRA1A P35348 1/20 0.57
ADRA1B P35368 1/20 0.57
NPSR1 Q6W5P4 1/20 0.56
ACACB O00763 1/20 0.45
LMNA P02545 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
AKR1C3 P42330 1/20 0.40
AKR1C2 P52895 1/20 0.40
NOTUM Q6P988 2/20 0.40
KCNH2 Q12809 2/20 0.38
TMEM97 Q5BJF2 1/20 0.38
SIGMAR1 Q99720 1/20 0.38
PNMT P11086 1/20 0.38
DRD2 P14416 1/20 0.37
ALDH1A1 P00352 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
SCHEMBL23102140 0.87 ADRA2A (0.57) ADRA2AADRA2BADRA2CCYP2D6ADRA1D
SCHEMBL12367365 0.84 ADRA2A (0.44) ADRA2AADRA2BADRA2CCYP2D6ADRA1D
SCHEMBL22436028 0.81 NOTUM (0.38) ADRA2AADRA2BADRA2CCYP2D6ADRA1D
SCHEMBL27010062 0.80 KCNH2 (0.48) NOTUMKCNH2TMEM97SIGMAR1DRD2
SCHEMBL15845886 0.80 CARM1 (0.49) ADRA2AADRA2BADRA2CACACBAKR1C3
SCHEMBL19755625 0.80 HRH3 (0.36) ADRA2AADRA2BADRA2CCYP2D6ADRA1D
SCHEMBL21216374 0.80 BCL2L1 (0.46) LMNAAKR1C3KCNH2DRD2ALDH1A1
SCHEMBL16624023 0.79 ALDH1A1 (0.38) ADRA2AADRA2BADRA2CCYP2D6ADRA1D
SCHEMBL25465443 0.78 ACACB (0.38) ADRA2AADRA2BADRA2CCYP2D6ADRA1D
SCHEMBL25463314 0.78 CSF1R (0.41) ADRA2AADRA2BADRA2CLMNAKCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3765447-B1 TRIAZACYCLODODECANSULFONAMIDE (\"TCD\")-BASED PROTEIN SECRETION INHIBITORS KEZAR LIFE SCIENCES (US) 2023-07-12 EP disclosed
US-11578055-B2 Triazacyclododecansulfonamide (“TCD”)-based protein secretion inhibitors KEZAR LIFE SCIENCES (US) 2023-02-14 US disclosed
US-20220402891-A1 TRIAZACYCLODODECANSULFONAMIDE (TCD)-BASED PROTEIN SECRETION INHIBITORS ENODIA THERAPEUTICS SAS (FR) 2022-12-22 US disclosed
EP-3194367-B1 TETRAHYDROISOQUINOLINE DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS USEFUL FOR THE TREATMENT OF OBESITY AND DIABETES BOEHRINGER INGELHEIM INT (DE) 2021-08-18 EP disclosed
US-20210078974-A1 TRIAZACYCLODODECANSULFONAMIDE (\"TCD\")-BASED PROTEIN SECRETION INHIBITORS ENODIA THERAPEUTICS SAS (FR) 2021-03-18 US disclosed
WO-2019178510-A1 TRIAZACYCLODODECANSULFONAMIDE (\"TCD\")-BASED PROTEIN SECRETION INHIBITORS KEZAR LIFE SCIENCES (US) 2019-09-19 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 (3 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-11578055-B2 Triazacyclododecansulfonamide (“TCD”)-based protein secretion inhibitors SEC61B, SEC61A1, SEC61G ADRA2A 4627/4885ADRA2B 4222/4885ADRA2C 4666/4885
US-20220402891-A1 TRIAZACYCLODODECANSULFONAMIDE (TCD)-BASED PROTEIN SECRETION INHIBITORS SEC61B, SEC61A1, SEC61G ADRA2A 4579/4885ADRA2B 4209/4885ADRA2C 4625/4885
US-20210078974-A1 TRIAZACYCLODODECANSULFONAMIDE (\"TCD\")-BASED PROTEIN SECRETION INHIBITORS SEC61B, SEC61A1, SEC61G ADRA2A 4567/4885ADRA2B 4097/4885ADRA2C 4596/4885

“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.