SCHEMBL25916122

SCHEMBL25916122

Cc1ccccc1-c1cccc(CN2CCC3(CC2)C(N2CCCCC2)=NC(=O)N3c2cccc(F)c2)c1

nearest known ligand 0.64

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 6/20 0.64
HTT P42858 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
BACE2 Q9Y5Z0 1/20 0.40
ALDH1A1 P00352 2/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
KMT2A Q03164 2/20 0.39
DRD2 P14416 3/20 0.37
DRD4 P21917 3/20 0.37
DRD3 P35462 3/20 0.37
HSD11B1 P28845 1/20 0.37
DOCK5 Q9H7D0 1/20 0.36
CYP2D6 P10635 1/20 0.35
MAPK1 P28482 1/20 0.35
ALDH3A1 P30838 1/20 0.35
ACHE P22303 1/20 0.35
MEN1 O00255 1/20 0.34

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
SCHEMBL593631 0.85 BACE1 (0.61) BACE1BACE2ALDH1A1SMN1; SMN2KMT2A
SCHEMBL593730 0.84 BACE1 (0.66) BACE1BACE2ALDH1A1SMN1; SMN2HSD11B1
SCHEMBL3479520 0.81 BACE1 (0.73) BACE1BACE2ALDH1A1KMT2ADRD2
SCHEMBL3479519 0.81 BACE1 (0.73) BACE1BACE2ALDH1A1KMT2ADRD2
SCHEMBL3492836 0.80 BACE1 (0.43) BACE1BACE2ALDH1A1SMN1; SMN2KMT2A
SCHEMBL3479574 0.79 BACE1 (0.63) BACE1BACE2ALDH1A1KMT2ADRD2
SCHEMBL594009 0.79 BACE1 (0.57) BACE1BACE2
SCHEMBL25916121 0.78 BACE1 (0.62) BACE1HTTBACE2ALDH1A1SMN1; SMN2
SCHEMBL592835 0.78 BACE1 (0.58) BACE1BACE2ALDH1A1SMN1; SMN2DOCK5
SCHEMBL593738 0.76 BACE1 (0.56) BACE1BACE2ALDH1A1DRD2DRD4

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-20230218629-A1 THERAPEUTIC COMPOSITIONS AND METHODS FOR PREVENTION AND TREATMENT OF DIASTOLIC DYSFUNCTION Ambetex Pty Ltd (AU) 2023-07-13 US disclosed
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 5/4885HTT 1401/4885NPSR1 3452/4885

“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.