SCHEMBL6017115

SCHEMBL6017115

CCCc1nc(C)c(C)c(=O)n1Cc1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 5/20 0.56
PDE4B Q07343 5/20 0.56
PDE4C Q08493 5/20 0.56
PDE4D Q08499 5/20 0.56
PDE3B Q13370 1/20 0.51
PDE3A Q14432 1/20 0.51
CASR P41180 1/20 0.48
TLR7 Q9NYK1 3/20 0.47
AGTR1 P30556 1/20 0.47
AGTR2 P50052 1/20 0.47
MAPT P10636 2/20 0.46
LMNA P02545 1/20 0.46
MEN1 O00255 1/20 0.45
ALDH1A1 P00352 1/20 0.45
KMT2A Q03164 1/20 0.45
PPARG P37231 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
SCHEMBL2348949 0.80 PDE4A (0.85) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL3871568 0.79 SMN1; SMN2 (0.53) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL3869328 0.78 MAPT (0.50) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL3864855 0.78 PDE4A (0.53) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL6512906 0.76 PDE4A (0.86) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL5353533 0.76 PDE4A (0.58) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL5765941 0.75 PDE4A (0.51) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL14423584 0.75 PDE4A (0.57) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL5103773 0.75 PDE4A (0.60) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL5563021 0.75 PDE4A (0.64) PDE4APDE4BPDE4CPDE4DPDE3B

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-1682534-A2 PYRIMIDIN-4-ONE COMPOUNDS, COMPOSITIONS, AND METHODS Cytokinetics, Inc. (US) 2006-07-26 EP disclosed
US-20050197327-A1 Compounds, compositions, and methods CYTOKINETICS, INCORPORATED 2005-09-08 US disclosed
WO-2005041888-A2 PYRIMIDIN-4-ONE COMPOUNDS, COMPOSITIONS AND METHODS CYTOKINETICS, INC. (US) 2005-05-12 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-20050197327-A1 Compounds, compositions, and methods ALPP, PCNA, MKI67 PDE4A 2495/4885PDE4B 2576/4885PDE4C 2287/4885

“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.