SCHEMBL8377017

SCHEMBL8377017

CCCn1cc(C2(c3cccc(-c4cccnc4F)c3)N=C(N)N(C)C2=O)cc1CO

nearest known ligand 0.68

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 20/20 0.68
BACE2 Q9Y5Z0 19/20 0.68
CTSD P07339 18/20 0.68

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
SCHEMBL3578628 0.94 BACE1 (0.71) BACE1BACE2CTSD
SCHEMBL14625457 0.93 BACE1 (0.72) BACE1BACE2CTSD
SCHEMBL8380612 0.91 BACE1 (0.67) BACE1BACE2CTSD
SCHEMBL3576510 0.87 BACE1 (0.71) BACE1BACE2CTSD
SCHEMBL3579631 0.87 BACE1 (0.71) BACE1BACE2CTSD
SCHEMBL3572495 0.87 BACE1 (0.71) BACE1BACE2CTSD
SCHEMBL3573100 0.86 BACE1 (0.71) BACE1BACE2CTSD
SCHEMBL3575464 0.86 BACE1 (0.67) BACE1BACE2CTSD
SCHEMBL3573829 0.85 BACE1 (0.69) BACE1BACE2CTSD
SCHEMBL3568560 0.85 BACE1 (0.71) BACE1BACE2CTSD

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-7417047-B2 Amino-5-(5-membered)hetero-arylimidazolone compounds and the use thereof for β-secretase modulation WYETH (US) 2008-08-26 US disclosed
US-20070004786-A1 Amino-5-(5-membered)hetero-arylimidazolone compounds and the use thereof for beta-secretase modulation WYETH (US) 2007-01-04 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-20070004786-A1 Amino-5-(5-membered)hetero-arylimidazolone compounds and the use thereof for beta-secretase modulation BACE1, BACE2, APP BACE1 1/4885BACE2 2/4885CTSD 110/4885

“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.