SCHEMBL4309441

SCHEMBL4309441

CCc1cc(C2(c3ccc(F)cc3)N=C(N)N(C)C2=O)ccc1OC(F)F

nearest known ligand 0.67

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 20/20 0.67
APP P05067 2/20 0.67
CTSD P07339 3/20 0.65
BACE2 Q9Y5Z0 3/20 0.65
REN P00797 2/20 0.60

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
SCHEMBL8143694 0.92 BACE1 (0.77) BACE1APPCTSDBACE2REN
SCHEMBL4308372 0.92 BACE1 (0.77) BACE1APPCTSDBACE2REN
SCHEMBL13953386 0.89 BACE1 (0.62) BACE1APPCTSDBACE2REN
SCHEMBL13953510 0.89 BACE1 (0.62) BACE1APPCTSDBACE2REN
SCHEMBL13953589 0.89 BACE1 (0.62) BACE1APPCTSDBACE2REN
SCHEMBL4309940 0.88 BACE1 (0.61) BACE1APPCTSDBACE2REN
SCHEMBL13932830 0.87 BACE1 (0.86) BACE1APPCTSDBACE2REN
SCHEMBL8157422 0.87 BACE1 (0.86) BACE1APPCTSDBACE2REN
SCHEMBL4306222 0.87 BACE1 (0.86) BACE1APPCTSDBACE2REN
SCHEMBL13953471 0.87 BACE1 (0.61) BACE1APPCTSDBACE2REN

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-20090042964-A1 AMINO-5-[SUBSTITUTED-4-(DIFLUOROMETHOXY)PHENYL]-5-PHENYLIMIDAZOLONE COMPOUNDS AS BETA-SECRETASE INHIBITORS WYETH (US) 2009-02-12 US claimed
US-20090042964-A1 AMINO-5-[SUBSTITUTED-4-(DIFLUOROMETHOXY)PHENYL]-5-PHENYLIMIDAZOLONE COMPOUNDS AS BETA-SECRETASE INHIBITORS WYETH (US) 2009-02-12 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-20090042964-A1 AMINO-5-[SUBSTITUTED-4-(DIFLUOROMETHOXY)PHENYL]-5-PHENYLIMIDAZOLONE COMPOUNDS AS BETA-SECRETASE INHIBITORS BACE1, BACE2, APP BACE1 1/4885APP 3/4885CTSD 88/4885

“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.