SCHEMBL4486667

SCHEMBL4486667

CCCC[C@H](C(N)=O)[C@@H](CCC1CC1)C(=O)NC1CN(c2ccccc2)c2ccccc2N(Cc2cccc(-c3ccc(C)cc3)c2)C1=O

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ XIAP P98170 12/20 0.48
▸ PSEN1 P49768 1/20 0.41
▸ PSEN2 P49810 1/20 0.41
▸ APH1B Q8WW43 1/20 0.41
▸ NCSTN Q92542 1/20 0.41
▸ APH1A Q96BI3 1/20 0.41
▸ PSENEN Q9NZ42 1/20 0.41
▸ APP P05067 4/20 0.40
▸ CYP3A4 P08684 2/20 0.39
▸ NPY1R P25929 1/20 0.37
▸ MME P08473 1/20 0.35
▸ ACE P12821 1/20 0.35
▸ NOTCH1 P46531 1/20 0.35
▸ RBPJ Q06330 1/20 0.35

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
SCHEMBL5620022 0.94 XIAP (0.49) XIAPPSEN1PSEN2APH1BNCSTN
SCHEMBL4497034 0.92 XIAP (0.48) XIAPPSEN1PSEN2APH1BNCSTN
SCHEMBL4485818 0.92 XIAP (0.48) XIAPPSEN1PSEN2APH1BNCSTN
SCHEMBL4479568 0.90 XIAP (0.51) XIAPPSEN1PSEN2APH1BNCSTN
SCHEMBL4499460 0.90 XIAP (0.49) XIAPPSEN1PSEN2APH1BNCSTN
SCHEMBL4475754 0.88 XIAP (0.44) XIAPPSEN1PSEN2APH1BNCSTN
SCHEMBL7246486 0.88 XIAP (0.44) XIAPPSEN1PSEN2APH1BNCSTN
SCHEMBL4490420 0.88 XIAP (0.48) XIAPPSEN1PSEN2APH1BNCSTN
SCHEMBL4493190 0.88 XIAP (0.48) XIAPPSEN1PSEN2APH1BNCSTN
SCHEMBL4492156 0.87 XIAP (0.44) XIAPPSEN1PSEN2APH1BNCSTN

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-7507815-B2 Succinoylamino lactams as inhibitors of a-β protein production BRISTOL-MYERS SQUIBB PHARMA COMPANY (US) 2009-03-24 — — US disclosed
US-20080293692-A1 SUCCINOYLAMINO LACTAMS AS INHIBITORS OF A-BETA PROTEIN PRODUCTION BRISTOL-MYERS SQUIBB PHARMA COMPANY (US) 2008-11-27 — — 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-20080293692-A1 SUCCINOYLAMINO LACTAMS AS INHIBITORS OF A-BETA PROTEIN PRODUCTION BACE1, APH1A, APP XIAP 559/4885PSEN1 7/4885PSEN2 9/4885

“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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