SCHEMBL4869229

SCHEMBL4869229

COc1nc2cccnc2n1-c1ccc(-c2nc(-c3nccs3)cn2-c2ccc(C)nc2)cc1

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 9/20 0.45
PDE4B Q07343 1/20 0.35
AKT1 P31749 4/20 0.34
AKT2 P31751 2/20 0.34
MEN1 O00255 3/20 0.34
KMT2A Q03164 3/20 0.34
MAPT P10636 1/20 0.34
POLB P06746 1/20 0.33
PABPC1 P11940 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
AKT3 Q9Y243 1/20 0.32

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
SCHEMBL4876503 0.90 PDE10A (0.45) PDE10APDE4BAKT1AKT2MEN1
SCHEMBL4805276 0.88 PDE10A (0.45) PDE10APDE4BAKT1AKT2MEN1
SCHEMBL4810228 0.88 MEN1 (0.47) PDE10APDE4BAKT1AKT2MEN1
SCHEMBL4855612 0.87 MEN1 (0.39) PDE10APDE4BAKT1MEN1KMT2A
SCHEMBL4879382 0.87 PDE10A (0.49) PDE10APDE4BAKT1AKT2MEN1
SCHEMBL4869091 0.86 PDE10A (0.45) PDE10APDE4BAKT1AKT2MEN1
SCHEMBL4809409 0.86 PTGS2 (0.36) PDE10APDE4BAKT1AKT2MEN1
SCHEMBL4869914 0.86 PDE4B (0.35) PDE10APDE4BAKT1AKT2MEN1
SCHEMBL4869201 0.85 PDE4B (0.35) PDE10APDE4BAKT1AKT2MEN1
SCHEMBL4856160 0.85 PDE10A (0.46) PDE10APDE4BAKT1AKT2MEN1

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-20080090834-A1 SELECTIVE AZOLE PDE10A INHIBITOR COMPOUNDS PFIZER INC 2008-04-17 US claimed
US-20080090834-A1 SELECTIVE AZOLE PDE10A INHIBITOR COMPOUNDS PFIZER INC 2008-04-17 US disclosed
US-20080090834-A1 SELECTIVE AZOLE PDE10A INHIBITOR COMPOUNDS PFIZER INC 2008-04-17 US disclosed
US-20080090834-A1 SELECTIVE AZOLE PDE10A INHIBITOR COMPOUNDS PFIZER INC 2008-04-17 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 (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-20080090834-A1 SELECTIVE AZOLE PDE10A INHIBITOR COMPOUNDS PDE5A, PDE3B, PDE12 PDE10A 8/4885PDE4B 12/4885AKT1 1523/4885

“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.