SCHEMBL5457802

SCHEMBL5457802

COc1ccc2c(c1)C(NC(N)=O)CC2

nearest known ligand 0.55

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 1/20 0.55
PDE4B Q07343 1/20 0.55
PDE4C Q08493 1/20 0.55
PDE4D Q08499 1/20 0.55
MTNR1A P48039 10/20 0.54
MTNR1B P49286 10/20 0.52
NQO2 P16083 8/20 0.52
PDE10A Q9Y233 1/20 0.52
KDM1A O60341 1/20 0.51
MAOA P21397 1/20 0.51
MAOB P27338 1/20 0.51
HCRTR1 O43613 1/20 0.51
HCRTR2 O43614 1/20 0.51
ACHE P22303 1/20 0.50

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
SCHEMBL2466357 0.87 MTNR1A (0.62) PDE4APDE4BPDE4CPDE4DMTNR1A
SCHEMBL8501324 0.87 MTNR1A (0.62) PDE4APDE4BPDE4CPDE4DMTNR1A
SCHEMBL4427914 0.87 MTNR1A (0.62) PDE4APDE4BPDE4CPDE4DMTNR1A
SCHEMBL9630654 0.83 MTNR1A (0.65) PDE4APDE4BPDE4CPDE4DMTNR1A
SCHEMBL11602838 0.80 MEN1 (0.57) MTNR1AMTNR1BNQO2KDM1AMAOA
SCHEMBL5484314 0.79 ACHE (0.60) PDE4APDE4BPDE4CPDE4DMTNR1A
SCHEMBL4017021 0.79 MTNR1A (0.54) MTNR1AMTNR1BNQO2PDE10A
SCHEMBL11009151 0.78 MTNR1A (0.55) PDE4APDE4BPDE4CPDE4DMTNR1A
SCHEMBL2825083 0.78 MTNR1A (0.54) MTNR1AMTNR1BNQO2
Hydrochloric Acid SCHEMBL9630772 0.78 ACHE (0.63) PDE4APDE4BPDE4CPDE4DMTNR1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070021450-A1 Indanylamino uracils and their use as antioxidants and neuroprotectants TEVA PHARMACEUTICAL INDUSTRIES, LTD. (IL) 2007-01-25 US disclosed
WO-2006020070-A2 INDANYLAMINO URACILS AND THEIR USE AS ANTIOXIDANTS AND NEUROPROTECTANTS TEVA PHARMACEUTICAL INDUSTRIES, LTD. (IL) 2006-02-23 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-20070021450-A1 Indanylamino uracils and their use as antioxidants and neuroprotectants OGG1, CBR3, C1R PDE4A 3228/4885PDE4B 3410/4885PDE4C 3053/4885

“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.