SCHEMBL5948015

SCHEMBL5948015

C=CCC(C(N)=O)C(CC(C)C)C(=O)NC1CCc2ccccc2N(C)C1=O

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ NOTCH1 P46531 3/20 0.53
▸ RBPJ Q06330 3/20 0.53
▸ MME P08473 2/20 0.50
▸ ACE P12821 2/20 0.50
▸ SCN9A Q15858 1/20 0.48
▸ XIAP P98170 9/20 0.47
▸ RIPK1 Q13546 3/20 0.46
▸ PSEN1 P49768 2/20 0.45
▸ PSEN2 P49810 2/20 0.45
▸ APH1B Q8WW43 2/20 0.45
▸ NCSTN Q92542 2/20 0.45
▸ APH1A Q96BI3 2/20 0.45
▸ PSENEN Q9NZ42 2/20 0.45

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
SCHEMBL3287904 1.00 NOTCH1 (0.53) NOTCH1RBPJMMEACESCN9A
SCHEMBL3289472 0.84 NOTCH1 (0.61) NOTCH1RBPJPSEN1PSEN2APH1B
SCHEMBL3286164 0.78 PSEN1 (0.64) NOTCH1RBPJPSEN1PSEN2APH1B
SCHEMBL4108341 0.78 PSEN1 (0.64) NOTCH1RBPJPSEN1PSEN2APH1B
SCHEMBL7246830 0.78 NOTCH1 (0.57) NOTCH1RBPJPSEN1PSEN2APH1B
SCHEMBL3289624 0.77 NOTCH1 (0.69) NOTCH1RBPJPSEN1PSEN2APH1B
SCHEMBL4485658 0.77 APP (0.58) NOTCH1RBPJPSEN1PSEN2APH1B
SCHEMBL3286623 0.77 NOTCH1 (0.66) NOTCH1RBPJPSEN1PSEN2APH1B
SCHEMBL4490715 0.76 APP (0.68) NOTCH1RBPJPSEN1PSEN2APH1B
SCHEMBL13875791 0.76 SCN9A (0.53) MMEACESCN9AXIAPRIPK1

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-20060025407-A1 Succinoylaminobenzodiazepines as inhibitors of Abeta protein production DUPONT PHARMACEUTICALS (US) 2006-02-02 — — 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-20060025407-A1 Succinoylaminobenzodiazepines as inhibitors of Abeta protein production BACE1, APP, APH1B NOTCH1 134/4885RBPJ 2432/4885MME 657/4885

“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.

Send feedback