SCHEMBL19965901

SCHEMBL19965901

NCCCNCCNCCCNc1c2c(nc3ccccc13)CCCC2

nearest known ligand 0.88

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ACHE P22303 6/20 0.80
BCHE P06276 1/20 0.73

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
SCHEMBL5487643 0.94 ACHE (0.90) ACHEBCHE
SCHEMBL27855737 0.93 ACHE (0.93) ACHEBCHE
SCHEMBL5485655 0.90 ACHE (0.97) ACHEBCHE
SCHEMBL5945371 0.89 ACHE (1.00) ACHEBCHE
SCHEMBL1537859 0.89 ACHE (1.00) ACHEBCHE
SCHEMBL5945380 0.89 ACHE (1.00) ACHEBCHE
SCHEMBL5489233 0.89 ACHE (1.00) ACHEBCHE
SCHEMBL5486217 0.89 ACHE (1.00) ACHEBCHE
SCHEMBL13480729 0.89 BCHE (0.92) ACHEBCHE
SCHEMBL27995331 0.87 BCHE (0.75) ACHEBCHE

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-10017476-B2 1,4-bis(3-aminopropyl)piperazine derivative and its use INSERM (INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE) (FR) 2018-07-10 US disclosed
US-20180072679-A1 NOVEL 1,4-BIS(3-AMINOPROPYL)PIPERAZINE DERIVATIVE AND ITS USE INSERM ( INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE) (FR) 2018-03-15 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 (2 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-20180072679-A1 NOVEL 1,4-BIS(3-AMINOPROPYL)PIPERAZINE DERIVATIVE AND ITS USE MAPT, PSEN1, PSEN2 ACHE 413/4885BCHE 232/4885
US-10017476-B2 1,4-bis(3-aminopropyl)piperazine derivative and its use MAPT, PSEN1, PSEN2 ACHE 146/4885BCHE 198/4885

“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.