SCHEMBL4238384

SCHEMBL4238384

COc1cccc(CC2(c3ccccc3)N=C(N)N(C)C2=O)c1

nearest known ligand 0.63

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 16/20 0.63
BACE2 Q9Y5Z0 5/20 0.63
PRMT5 O14744 2/20 0.51
WDR77 Q9BQA1 2/20 0.51
CTSD P07339 1/20 0.50
REN P00797 1/20 0.47
APP P05067 1/20 0.47

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
SCHEMBL4228912 0.87 BACE1 (0.64) BACE1BACE2PRMT5WDR77CTSD
SCHEMBL8237931 0.85 BACE1 (0.59) BACE1BACE2PRMT5WDR77CTSD
SCHEMBL5067102 0.83 BACE1 (0.63) BACE1BACE2CTSD
SCHEMBL8241016 0.77 BACE1 (0.72) BACE1BACE2CTSD
SCHEMBL4238901 0.77 BACE1 (1.00) BACE1BACE2CTSDRENAPP
Trifluoroacetic Acid SCHEMBL4233715 0.77 BACE1 (0.68) BACE1BACE2CTSD
Trifluoroacetic Acid SCHEMBL4239010 0.77 PRMT5 (0.53) BACE1BACE2PRMT5WDR77CTSD
SCHEMBL4236830 0.75 BACE1 (0.92) BACE1BACE2CTSDRENAPP
SCHEMBL13778571 0.75 PRMT5 (0.62) BACE1BACE2PRMT5WDR77CTSD
SCHEMBL8238551 0.75 BACE1 (0.64) BACE1BACE2PRMT5WDR77CTSD

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-20090176850-A1 Novel 2-Amino-Imidazole-4-One Compounds And Their Use In The Manufacture Of A Medicament To Be Used In The Treatment Of Cognitive Impairment, Alzheimer's Disease, Neurodegeneration And Dementia ASTRAZENECA AB (SE) 2009-07-09 US claimed
EP-1954682-A1 NOVEL 2-AMINO-IMIDAZOLE-4-ONE COMPOUNDS AND THEIR USE IN THE MANUFACTURE OF A MEDICAMENT TO BE USED IN THE TREATMENT OF COGNITIVE IMPAIRMENT, ALZHEIMER S DISEASE, NEURODEGENERATION AND DEMENTIA Astra Zeneca AB (SE) 2008-08-13 EP claimed
WO-2007058601-A1 NOVEL 2-AMINO-IMIDAZOLE-4-ONE COMPOUNDS AND THEIR USE IN THE MANUFACTURE OF A MEDICAMENT TO BE USED IN THE TREATMENT OF COGNITIVE IMPAIRMENT, ALZHEIMER’S DISEASE, NEURODEGENERATION AND DEMENTIA ASTRAZENECA AB (SE) 2007-05-24 WO claimed
US-20090176850-A1 Novel 2-Amino-Imidazole-4-One Compounds And Their Use In The Manufacture Of A Medicament To Be Used In The Treatment Of Cognitive Impairment, Alzheimer's Disease, Neurodegeneration And Dementia ASTRAZENECA AB (SE) 2009-07-09 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-20090176850-A1 Novel 2-Amino-Imidazole-4-One Compounds And Their Use In The Manufacture Of A Medicament To Be Used In The Treatment Of Cognitive Impairment, Alzheimer's Disease, Neurodegeneration And Dementia PSEN2, MAPT, PSEN1 BACE1 7/4885BACE2 26/4885PRMT5 145/4885

“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.