SCHEMBL2353796

SCHEMBL2353796

CCCc1cc(N2CCN(C/C=C(\C)Cn3cc(C)c(=O)[nH]c3=O)CC2)nc(C(C)(C)C)n1

nearest known ligand 0.52

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 16/20 0.52
DRD3 P35462 16/20 0.52
TK1 P04183 3/20 0.34
ADRA1D P25100 1/20 0.33
ADRA1A P35348 1/20 0.33
ADRA1B P35368 1/20 0.33

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
SCHEMBL2353798 1.00 DRD2 (0.52) DRD2DRD3TK1ADRA1DADRA1A
SCHEMBL2350892 0.86 DRD2 (0.71) DRD2DRD3
SCHEMBL2350898 0.86 DRD2 (0.71) DRD2DRD3
SCHEMBL2355942 0.80 DRD2 (0.56) DRD2DRD3ADRA1DADRA1AADRA1B
SCHEMBL2350623 0.77 DRD2 (0.56) DRD2DRD3ADRA1DADRA1AADRA1B
Hydrochloric Acid SCHEMBL2350040 0.76 DRD2 (0.55) DRD2DRD3ADRA1DADRA1AADRA1B
SCHEMBL2346287 0.75 DRD2 (0.74) DRD2DRD3
Acetic Acid SCHEMBL2352161 0.74 DRD2 (0.68) DRD2DRD3
SCHEMBL2353833 0.74 DRD2 (0.75) DRD2DRD3
Fumaric Acid SCHEMBL2353845 0.73 DRD2 (0.66) DRD2DRD3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8008488-B2 Pyrimidin-2-one compounds and their use as dopamine D3 receptor ligands ABBOTT GMBH & CO. KG (DE) 2011-08-30 US disclosed
EP-1601659-B1 PYRIMIDIN-2-ONE COMPOUNDS AND THEIR USE AS DOPAMINE D3 RECEPTOR LIGANDS ABBOTT GMBH & CO KG (DE) 2008-01-16 EP disclosed
US-20060235004-A1 Pyrimidin-2-one compounds and their use as dopamine d3 receptor ligands ABBOT GMBH & CO. KG (DE) 2006-10-19 US disclosed
EP-1601659-A1 PYRIMIDIN-2-ONE COMPOUNDS AND THEIR USE AS DOPAMINE D3 RECEPTOR LIGANDS Abbott GmbH & Co. KG (DE) 2005-12-07 EP disclosed
WO-2004080981-A1 PYRIMIDIN-2-ONE COMPOUNDS AND THEIR USE AS DOPAMINE D3 RECEPTOR LIGANDS ABBOTT GMBH & CO. KG (DE) 2004-09-23 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-20060235004-A1 Pyrimidin-2-one compounds and their use as dopamine d3 receptor ligands ADRB3, DRD3, OPRL1 DRD2 18/4885DRD3 2/4885TK1 968/4885

“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.