SCHEMBL4471773

SCHEMBL4471773

CCN(CC)Cc1ccc(NC)cc1

nearest known ligand 0.61

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 4/20 0.61
HDAC8 Q9BY41 1/20 0.50
HDAC6 Q9UBN7 1/20 0.50
BCHE P06276 1/20 0.42
ACHE P22303 1/20 0.42
PYCR1 P32322 1/20 0.42
CNR2 P34972 1/20 0.41

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
SCHEMBL22422641 0.85 MAPT (0.54) HRH3
SCHEMBL7768079 0.83 HRH3 (0.84) HRH3HDAC8HDAC6PYCR1CNR2
SCHEMBL1206283 0.83 HRH3 (0.64) HRH3BCHE
SCHEMBL7317159 0.81 HDAC6 (0.47) HRH3HDAC8HDAC6BCHE
SCHEMBL13811533 0.79 KCNH2 (0.41) HRH3
SCHEMBL28629479 0.78 HRH3 (0.55) HRH3HDAC8HDAC6BCHEACHE
SCHEMBL9970753 0.77 HRH3 (0.58) HRH3HDAC6
SCHEMBL12680476 0.77 HRH3 (1.00) HRH3HDAC8HDAC6PYCR1CNR2
SCHEMBL5926009 0.77 HRH3 (0.73) HRH3HDAC8HDAC6PYCR1CNR2
SCHEMBL8401340 0.76 HRH3 (0.53) HRH3HDAC8HDAC6BCHEACHE

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
US-7531668-B2 2-arylcarboxamide-nitrogenous heterocycle compound BANYU PHARMACEUTICAL CO., LTD. (JP) 2009-05-12 US disclosed
US-20070299070-A1 2-Arylcarboxamide-Nitrogenous Heterocycle Compound MSD K.K. (JP) 2007-12-27 US disclosed
CN-101065356-A 2-arylcarboxamide-nitrogen-containing heterocyclic compounds BANYU PHARMA CO LTD (JP) 2007-10-31 CN disclosed
EP-1798221-A1 2-ARYLCARBOXAMIDE-NITROGENEOUS HETEROCYCLE COMPOUND BANYU PHARMACEUTICAL CO., LTD. (JP) 2007-06-20 EP 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-20070299070-A1 2-Arylcarboxamide-Nitrogenous Heterocycle Compound MCHR2, MCHR1, NPY2R HRH3 98/4885HDAC8 1061/4885HDAC6 2530/4885

“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.