SCHEMBL4977833

SCHEMBL4977833

COc1cc2ncnc(N3CCN(C(=O)OC(C)(C)C)C(c4ccccc4)C3)c2cc1OC

nearest known ligand 0.57

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PDE3A Q14432 2/20 0.57
PDE10A Q9Y233 5/20 0.56
PDGFRB P09619 4/20 0.55
PDGFRA P16234 1/20 0.55
AURKA O14965 1/20 0.54
ACHE P22303 3/20 0.54
BACE1 P56817 3/20 0.54
NR1H2 P55055 3/20 0.51
NR1H3 Q13133 3/20 0.51
HTR1A P08908 3/20 0.51
HTR7 P34969 3/20 0.51

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
SCHEMBL4977872 0.89 PDE3A (0.63) PDE3APDE10APDGFRBPDGFRAAURKA
SCHEMBL2918088 0.78 TLR9 (0.76) PDGFRBPDGFRAAURKAACHEBACE1
SCHEMBL906243 0.76 KIT (0.59) PDE3APDGFRBPDGFRAAURKAACHE
SCHEMBL5243679 0.75 PDE3A (0.68) PDE3APDE10AACHEBACE1HTR1A
SCHEMBL5241625 0.75 PDE3A (0.68) PDE3APDE10AACHEBACE1HTR1A
SCHEMBL5241619 0.75 PDE3A (0.68) PDE3APDE10AACHEBACE1HTR1A
SCHEMBL5241633 0.75 PDE3A (0.68) PDE3APDE10AACHEBACE1HTR1A
SCHEMBL5243694 0.75 PDE3A (0.68) PDE3APDE10AACHEBACE1HTR1A
SCHEMBL23726903 0.75 ACHE (0.67) PDGFRBPDGFRAAURKAACHEBACE1
SCHEMBL23726611 0.75 TLR9 (0.71) PDGFRBPDGFRAAURKAACHEBACE1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1994021-A2 QUINAZOLINE DERIVATIVES AS PHOSPHODIESTERASE 10 INHIBITORS Amgen Inc. (US) 2008-11-26 EP disclosed
US-20070265258-A1 Quinazoline derivatives as phosphodiesterase 10 inhibitors AMGEN INC. 2007-11-15 US disclosed
WO-2007103370-A2 QUINAZOLINE DERIVATIVES AS PHOSPHODIESTERASE 10 INHIBITORS AMGEN INC. (US) 2007-09-13 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-20070265258-A1 Quinazoline derivatives as phosphodiesterase 10 inhibitors PDE12, PDE5A, PDE7A PDE3A 6/4885PDE10A 5/4885PDGFRB 3598/4885

“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.