SCHEMBL4761676

SCHEMBL4761676

C=C(C)c1n[nH]c2c1CN(c1ncnc3cc(OC)c(OC)cc13)CC2

nearest known ligand 0.52

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ACHE P22303 10/20 0.52
BACE1 P56817 10/20 0.52
PDE10A Q9Y233 6/20 0.48
AURKA O14965 1/20 0.45
PDGFRB P09619 2/20 0.44
KIT P10721 1/20 0.44
PDGFRA P16234 1/20 0.44
FLT3 P36888 1/20 0.44
ENPP1 P22413 1/20 0.44

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
Formic Acid SCHEMBL4762901 0.95 ACHE (0.48) ACHEBACE1PDE10AAURKAPDGFRB
SCHEMBL8250709 0.93 ACHE (0.44) ACHEBACE1PDE10AAURKAPDGFRB
SCHEMBL8247275 0.88 ACHE (0.53) ACHEBACE1PDE10AAURKAPDGFRB
SCHEMBL4760323 0.87 ACHE (0.52) ACHEBACE1PDE10AAURKAPDGFRB
SCHEMBL4761702 0.86 ACHE (0.50) ACHEBACE1PDE10AAURKAPDGFRB
Trifluoroacetic Acid SCHEMBL4760864 0.84 ACHE (0.48) ACHEBACE1PDE10AAURKAPDGFRB
SCHEMBL4760245 0.84 MAPK1 (0.55) ACHEBACE1PDE10AAURKAPDGFRB
SCHEMBL4759917 0.84 ACHE (0.51) ACHEBACE1PDE10AAURKAENPP1
Formic Acid SCHEMBL5471549 0.83 ACHE (0.47) ACHEBACE1AURKAPDGFRBKIT
SCHEMBL4760867 0.83 ACHE (0.47) ACHEBACE1PDE10AAURKAPDGFRB

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-1940819-A1 PHOSPHODIESTERASE 10 INHIBITORS Memory Pharmaceuticals Corporation (US) 2008-07-09 EP disclosed
US-20070093515-A1 Phosphodiesterase 10 inhibitors AMGEN INC. 2007-04-26 US disclosed
US-20070093515-A1 Phosphodiesterase 10 inhibitors AMGEN INC. 2007-04-26 US disclosed
US-20070093515-A1 Phosphodiesterase 10 inhibitors AMGEN INC. 2007-04-26 US disclosed
WO-2007022280-A1 PHOSPHODIESTERASE 10 INHIBITORS MEMORY PHARMACEUTICALS CORPORATION (US) 2007-02-22 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-20070093515-A1 Phosphodiesterase 10 inhibitors PDE7A, PDE12, PDE10A ACHE 66/4885BACE1 707/4885PDE10A 3/4885

“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.