SCHEMBL6915060

SCHEMBL6915060

CCCC(O)CC1(C(=O)N[C@H]2N=C(c3ccccc3)c3ccccc3N(C)C2=O)CCCC1

nearest known ligand 0.64

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PSEN1 P49768 9/20 0.64
PSEN2 P49810 9/20 0.64
APH1B Q8WW43 9/20 0.64
NCSTN Q92542 9/20 0.64
APH1A Q96BI3 9/20 0.64
PSENEN Q9NZ42 9/20 0.64
CCKBR P32239 5/20 0.57
NOTCH1 P46531 2/20 0.56
RBPJ Q06330 1/20 0.56
CCKAR P32238 1/20 0.56
NOTCH3 Q9UM47 1/20 0.55

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
SCHEMBL6910028 0.85 PSEN1 (0.70) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL6909659 0.83 PSEN1 (0.68) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL13434951 0.79 CCKBR (0.75) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL3486798 0.79 CCKBR (0.75) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL13502668 0.79 PSEN1 (0.97) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL13547414 0.79 PSEN1 (0.97) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL13434949 0.78 CCKBR (0.77) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL5803563 0.78 PSEN1 (0.69) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL3486777 0.78 CCKBR (0.77) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL13547413 0.78 PSEN1 (0.84) PSEN1PSEN2APH1BNCSTNAPH1A

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6713476-B2 SUBSTITUTED LACTAM; GAMMA-SECRETASE INHIBITOR; DECREASES PRODUCTION OF BETA-AMYLOID; TREATMENT FOR ALTZHEIMER'S AND DOWN'S SYNDROME DUPONT PHARMACEUTICALS COMPANY 2004-03-30 US claimed
US-20020061874-A1 Substituted cycloalkyls as inhibitors of a beta protein production BRISTOL-MYERS SQUIBB PHARMA COMPANY 2002-05-23 US claimed
US-6713476-B2 SUBSTITUTED LACTAM; GAMMA-SECRETASE INHIBITOR; DECREASES PRODUCTION OF BETA-AMYLOID; TREATMENT FOR ALTZHEIMER'S AND DOWN'S SYNDROME DUPONT PHARMACEUTICALS COMPANY 2004-03-30 US disclosed
US-20020061874-A1 Substituted cycloalkyls as inhibitors of a beta protein production BRISTOL-MYERS SQUIBB PHARMA COMPANY 2002-05-23 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-20020061874-A1 Substituted cycloalkyls as inhibitors of a beta protein production APP, BACE1, APH1A PSEN1 6/4885PSEN2 8/4885APH1B 4/4885

“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.