SCHEMBL25916289

SCHEMBL25916289

Cc1cc([C@]2(c3cccc(-c4cncnc4)c3)N=C(N)c3c(F)cccc32)ccn1

nearest known ligand 0.81

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 20/20 0.81
KCNH2 Q12809 17/20 0.81
BACE2 Q9Y5Z0 6/20 0.79

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
SCHEMBL24363070 1.00 BACE1 (0.81) BACE1KCNH2BACE2
SCHEMBL2466400 0.90 BACE1 (0.67) BACE1KCNH2BACE2
SCHEMBL2467489 0.90 BACE1 (1.00) BACE1KCNH2BACE2
SCHEMBL2462456 0.89 BACE1 (0.66) BACE1KCNH2BACE2
SCHEMBL2469832 0.89 BACE1 (1.00) BACE1KCNH2BACE2
SCHEMBL2463319 0.89 BACE1 (1.00) BACE1KCNH2BACE2
SCHEMBL2499171 0.89 BACE1 (1.00) BACE1KCNH2BACE2
SCHEMBL2462010 0.87 BACE1 (1.00) BACE1KCNH2BACE2
Azd-3839 SCHEMBL12136074 0.86 BACE1 (1.00) BACE1KCNH2BACE2
SCHEMBL2462912 0.86 BACE1 (1.00) BACE1KCNH2BACE2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230218629-A1 THERAPEUTIC COMPOSITIONS AND METHODS FOR PREVENTION AND TREATMENT OF DIASTOLIC DYSFUNCTION Ambetex Pty Ltd (AU) 2023-07-13 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-20230218629-A1 THERAPEUTIC COMPOSITIONS AND METHODS FOR PREVENTION AND TREATMENT OF DIASTOLIC DYSFUNCTION TNNI3, TNNT2, TNNC1 BACE1 5/4885KCNH2 2268/4885BACE2 12/4885

“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.