SCHEMBL2064786

SCHEMBL2064786

CC(C)(C)OC(=O)N1CC2CN(c3cncc(OCc4ccccc4)n3)CC2C1

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 2/20 0.47
CKS1B P61024 2/20 0.45
SKP1 P63208 2/20 0.45
SKP2 Q13309 2/20 0.45
GPR119 Q8TDV5 9/20 0.43
JAK2 O60674 1/20 0.42
JAK1 P23458 1/20 0.42
ACHE P22303 1/20 0.41
USP30 Q70CQ3 1/20 0.41
TLR9 Q9NR96 1/20 0.40
TLR7 Q9NYK1 1/20 0.40
PRMT5 O14744 1/20 0.40

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
SCHEMBL2064787 1.00 PDE10A (0.47) PDE10ACKS1BSKP1SKP2GPR119
SCHEMBL2064801 0.90 GPR119 (0.42) PDE10AGPR119
SCHEMBL2064799 0.90 GPR119 (0.42) PDE10AGPR119
SCHEMBL2065473 0.87 GPR119 (0.42) PDE10AGPR119
SCHEMBL2065475 0.87 GPR119 (0.42) PDE10AGPR119
SCHEMBL3486873 0.87 GPR119 (0.59) CKS1BSKP1SKP2GPR119PRMT5
SCHEMBL2065818 0.82 HDAC1 (0.43) PDE10ACKS1BSKP1SKP2GPR119
SCHEMBL2065822 0.82 HDAC1 (0.43) PDE10ACKS1BSKP1SKP2GPR119
SCHEMBL652088 0.81 GPR119 (0.48) GPR119JAK2JAK1PRMT5
SCHEMBL652089 0.81 GPR119 (0.48) GPR119JAK2JAK1PRMT5

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
EP-2700639-A1 Selective ligands for the neuronal nicotinic receptors and uses thereof Abbvie Inc. (US) 2014-02-26 EP disclosed
US-8648084-B2 Selective substituted pyrazine ligands for neuronal nicotinic receptors ABBVIE INC. (US) 2014-02-11 US disclosed
US-20120190692-A1 SELECTIVE SUBSTITUTED PYRIDINE LIGANDS FOR NEURONAL NICOTINIC RECEPTORS ABBVIE INC. 2012-07-26 US disclosed
US-8148408-B2 Selective substituted pyridine ligands for neuronal nicotinic receptors ABBOTT LABORATORIES (US) 2012-04-03 US disclosed
US-20090281118-A1 Selective Ligands for the Neuronal Nicotinic Receptors and Uses Thereof ABBOTT LABORATORIES (US) 2009-11-12 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-20120190692-A1 SELECTIVE SUBSTITUTED PYRIDINE LIGANDS FOR NEURONAL NICOTINIC RECEPTORS CHRNA4, CHRNB4, CHRNA2 PDE10A 2610/4885CKS1B 1413/4885SKP1 2547/4885
US-20090281118-A1 Selective Ligands for the Neuronal Nicotinic Receptors and Uses Thereof CHRNA4, CHRNB4, CHRNA2 PDE10A 2131/4885CKS1B 1979/4885SKP1 3328/4885

“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.