SCHEMBL7259727

SCHEMBL7259727

CCCC[C@H](O)[C@@H](CC1CC1)C(=O)C1(N)N=C(c2nccs2)c2ccccc2N(C)C1=O

nearest known ligand 0.34

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NOTCH1 P46531 2/20 0.34
RBPJ Q06330 2/20 0.34
PSEN1 P49768 2/20 0.32
PSEN2 P49810 2/20 0.32
APH1B Q8WW43 2/20 0.32
NCSTN Q92542 2/20 0.32
APH1A Q96BI3 2/20 0.32
PSENEN Q9NZ42 2/20 0.32
TDP1 Q9NUW8 1/20 0.31
CTSK P43235 1/20 0.31
ALDH1A1 P00352 1/20 0.30
PORCN Q9H237 1/20 0.30

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
SCHEMBL7480904 0.91 CRHR1 (0.31) TDP1CTSK
SCHEMBL7487031 0.86 CCKBR (0.33) NOTCH1RBPJPSEN1PSEN2APH1B
SCHEMBL6385267 0.85 NOTCH1 (0.39) NOTCH1RBPJPSEN1PSEN2APH1B
SCHEMBL7481197 0.83 NOTCH1 (0.37) NOTCH1RBPJPSEN1PSEN2APH1B
SCHEMBL7598317 0.83 PSEN1 (0.40) NOTCH1RBPJPSEN1PSEN2APH1B
SCHEMBL7482520 0.83 PSEN1 (0.40) NOTCH1RBPJPSEN1PSEN2APH1B
SCHEMBL7484257 0.83 PSEN1 (0.40) NOTCH1RBPJPSEN1PSEN2APH1B
SCHEMBL7486538 0.83 PSEN1 (0.40) NOTCH1RBPJPSEN1PSEN2APH1B
SCHEMBL7483243 0.83 PSEN1 (0.34) NOTCH1RBPJPSEN1PSEN2APH1B
SCHEMBL7596106 0.81 CCKBR (0.34) NOTCH1RBPJTDP1ALDH1A1

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-20030166636-A1 Hydroxyalkanoylaminolactams and related structures as inhibitors of A-beta protein production OLSON RICHARD E (US) 2003-09-04 US claimed

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-20030166636-A1 Hydroxyalkanoylaminolactams and related structures as inhibitors of A-beta protein production APP, APH1A, APH1B NOTCH1 622/4885RBPJ 2748/4885PSEN1 6/4885

“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.