SCHEMBL6092723

SCHEMBL6092723

C=CC[C@H](C(N)=O)[C@@H](CC1CC1)C(=O)N[C@H]1N=C(c2ccccc2)c2ccccc2N(Cc2cccc(-c3ccc(OC)cc3)c2)C1=O

nearest known ligand 0.58

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ NOTCH1 P46531 6/20 0.58
▸ RBPJ Q06330 3/20 0.58
▸ NOTCH3 Q9UM47 3/20 0.48
▸ OXTR P30559 3/20 0.47
▸ CCKBR P32239 8/20 0.44
▸ PSEN1 P49768 1/20 0.43
▸ PSEN2 P49810 1/20 0.43
▸ APH1B Q8WW43 1/20 0.43
▸ NCSTN Q92542 1/20 0.43
▸ APH1A Q96BI3 1/20 0.43
▸ PSENEN Q9NZ42 1/20 0.43
▸ KCNH2 Q12809 1/20 0.42
▸ CALCRL Q16602 1/20 0.42

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
SCHEMBL4490028 1.00 NOTCH1 (0.58) NOTCH1RBPJNOTCH3OXTRCCKBR
SCHEMBL4491400 0.97 NOTCH1 (0.56) NOTCH1RBPJNOTCH3OXTRCCKBR
SCHEMBL4490382 0.97 NOTCH1 (0.56) NOTCH1RBPJNOTCH3OXTRCCKBR
SCHEMBL4471835 0.93 NOTCH1 (0.60) NOTCH1RBPJNOTCH3OXTRCCKBR
SCHEMBL4488717 0.92 NOTCH1 (0.70) NOTCH1RBPJNOTCH3OXTRCCKBR
SCHEMBL4495342 0.92 NOTCH1 (0.58) NOTCH1RBPJNOTCH3OXTRCCKBR
SCHEMBL4476488 0.91 NOTCH1 (0.54) NOTCH1RBPJNOTCH3OXTRCCKBR
SCHEMBL4487329 0.90 NOTCH1 (0.58) NOTCH1RBPJNOTCH3OXTRCCKBR
SCHEMBL4490200 0.90 NOTCH1 (0.58) NOTCH1RBPJNOTCH3OXTRCCKBR
SCHEMBL4487811 0.90 NOTCH1 (0.51) NOTCH1RBPJNOTCH3OXTRCCKBR

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-20060258638-A1 Succinoylamino lactams as inhibitors of A-beta protein production BRISTOL-MYERS SQUIBB PHARMA COMPANY (US) 2006-11-16 — — 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-20060258638-A1 Succinoylamino lactams as inhibitors of A-beta protein production BACE1, APH1A, APP NOTCH1 94/4885RBPJ 1902/4885NOTCH3 323/4885

“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.

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