SCHEMBL12969652

SCHEMBL12969652

CN1CCc2cccc(Cl)c2C1

nearest known ligand 0.79

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRA2A P08913 3/20 0.79
ADRA2B P18089 3/20 0.79
ADRA2C P18825 3/20 0.79
ADRA1D P25100 2/20 0.79
ADRA1A P35348 2/20 0.79
ADRA1B P35368 2/20 0.79
CYP2D6 P10635 1/20 0.79
NPSR1 Q6W5P4 1/20 0.77
MAOA P21397 2/20 0.57
MAOB P27338 2/20 0.57
DRD2 P14416 8/20 0.52
DRD5 P21918 7/20 0.52
DRD3 P35462 6/20 0.52
DRD1 P21728 6/20 0.52
DRD4 P21917 1/20 0.52
HTR1A P08908 1/20 0.48
CHRM5 P08912 1/20 0.48
CHRM1 P11229 1/20 0.48
CHRM3 P20309 1/20 0.48
HRH2 P25021 1/20 0.48

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
SCHEMBL8083358 0.89 ADRA2A (1.00) ADRA2AADRA2BADRA2CADRA1DADRA1A
Hydrochloric Acid SCHEMBL10871080 0.87 NPSR1 (1.00) ADRA2AADRA2BADRA2CADRA1DADRA1A
SCHEMBL14945587 0.85 ADRA2A (0.79) ADRA2AADRA2BADRA2CADRA1DADRA1A
SCHEMBL13452416 0.82 ADRA2A (0.58) ADRA2AADRA2BADRA2CADRA1DADRA1A
SCHEMBL7957052 0.79 MAOA (0.59) ADRA2AADRA2BADRA2CADRA1DADRA1A
SCHEMBL24582728 0.78 MAOA (0.57) ADRA2AADRA2BADRA2CADRA1DADRA1A
SCHEMBL3117967 0.78 MAOA (0.57) ADRA2AADRA2BADRA2CADRA1DADRA1A
SCHEMBL30391211 0.78 DRD2 (0.75) ADRA2AADRA2BADRA2CADRA1DADRA1A
SCHEMBL21195968 0.78 DRD2 (0.75) ADRA2AADRA2BADRA2CADRA1DADRA1A
SCHEMBL3186398 0.78 MAOA (0.57) ADRA2AADRA2BADRA2CADRA1DADRA1A

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 8 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
WO-2012130915-A1 SPIROALKENE CARBOXAMIDE DERIVATIVES AND THEIR USE AS CHEMOKINE RECEPTOR MODULATORS ARES TRADING S.A. (CH) 2012-10-04 WO disclosed
US-20090042862-A1 NOVEL COMPOUNDS BEST DESMOND JOHN 2009-02-12 US disclosed
US-20090042862-A1 NOVEL COMPOUNDS BEST DESMOND JOHN 2009-02-12 US disclosed
US-7446103-B2 Bicyclic benzamide compound as histamine H3 receptor ligand useful in the treatment of neurological diseases GLAXO GROUP LIMITED (GB) 2008-11-04 US disclosed
US-7446103-B2 Bicyclic benzamide compound as histamine H3 receptor ligand useful in the treatment of neurological diseases GLAXO GROUP LIMITED (GB) 2008-11-04 US disclosed
US-20070105838-A1 Bicyclic Benzamide Compoundssa as Histamine H3 Receptor Ligand Useful in the Treatment of Neurological Diseases GLAXO GROUP LIMITED (GB) 2007-05-10 US disclosed
US-20070105838-A1 Bicyclic Benzamide Compoundssa as Histamine H3 Receptor Ligand Useful in the Treatment of Neurological Diseases GLAXO GROUP LIMITED (GB) 2007-05-10 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 (2 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-20070105838-A1 Bicyclic Benzamide Compoundssa as Histamine H3 Receptor Ligand Useful in the Treatment of Neurological Diseases HRH3, HRH4, HRH1 ADRA2A 148/4885ADRA2B 263/4885ADRA2C 219/4885
US-20090042862-A1 NOVEL COMPOUNDS GRIN2C, GRIN2A, GRIN2B ADRA2A 200/4885ADRA2B 211/4885ADRA2C 140/4885

“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.