SCHEMBL3488147

SCHEMBL3488147

CCCCC[C@@H](CC1CC1)C(=O)NC1N=C(c2cc(C(F)(F)F)ccn2)c2ccccc2N(C)C1=O

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NOTCH1 P46531 5/20 0.47
NOTCH3 Q9UM47 4/20 0.47
PSEN1 P49768 4/20 0.46
PSEN2 P49810 4/20 0.46
APH1B Q8WW43 4/20 0.46
NCSTN Q92542 4/20 0.46
APH1A Q96BI3 4/20 0.46
PSENEN Q9NZ42 4/20 0.46
CCKBR P32239 8/20 0.45
CCKAR P32238 5/20 0.45
NOTCH2 Q04721 1/20 0.43
NOTCH4 Q99466 1/20 0.43
RBPJ Q06330 1/20 0.43

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
SCHEMBL3487753 0.90 CCKBR (0.50) NOTCH1NOTCH3PSEN1PSEN2APH1B
SCHEMBL4182406 0.89 NOTCH1 (0.49) NOTCH1NOTCH3PSEN1PSEN2APH1B
SCHEMBL4182410 0.89 NOTCH1 (0.49) NOTCH1NOTCH3PSEN1PSEN2APH1B
SCHEMBL3487374 0.88 CCKBR (0.52) NOTCH1NOTCH3PSEN1PSEN2APH1B
SCHEMBL3487371 0.88 CCKBR (0.52) NOTCH1NOTCH3PSEN1PSEN2APH1B
SCHEMBL13501672 0.83 CCKBR (0.63) NOTCH1NOTCH3PSEN1PSEN2APH1B
SCHEMBL3486674 0.83 CCKBR (0.63) NOTCH1NOTCH3PSEN1PSEN2APH1B
SCHEMBL3486334 0.83 CCKBR (0.63) NOTCH1NOTCH3PSEN1PSEN2APH1B
SCHEMBL13434960 0.83 CCKBR (0.46) NOTCH1NOTCH3PSEN1PSEN2APH1B
SCHEMBL14371751 0.82 CCKBR (0.54) NOTCH1NOTCH3PSEN1PSEN2APH1B

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 22 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070173491-A1 Substituted lactams as inhibitors of Abeta protein production BRISTOL-MYERS SQUIBB PHARMA COMPANY (US) 2007-07-26 US claimed
US-20050234039-A1 Prevent forming deposits of amyloid protein on nervous systems; Alzheimer's disease; Down syndrome HAN QI 2005-10-20 US claimed
US-20040138201-A1 Substituted lactams as inhibitors of Abeta protein production HAN QI (US) 2004-07-15 US claimed
US-6632812-B2 Alzheimer's disease; Down syndrom DUPONT PHARMACEUTICALS COMPANY 2003-10-14 US claimed
US-20020025955-A1 Substituted lactams as inhibitors of A beta protein production BRISTOL-MYERS SQUIBB PHARMA COMPANY 2002-02-28 US claimed
US-20100069373-A1 SUBSTITUTED LACTAMS AS INHIBITORS OF A BETA PROTEIN PRODUCTION BRISTOL-MYERS SQUIBB PHARMA COMPANY (US) 2010-03-18 US disclosed
US-20100056501-A1 SUBSTITUTED LACTAMS AS INHIBITORS OF ABETA PROTEIN PRODUCTION BRISTOL-MYERS SQUIBB PHARMA COMPANY (US) 2010-03-04 US disclosed
US-20100048541-A1 SUBSTITUTED LACTAMS AS INHIBITORS OF ABETA PROTEIN PRODUCTION BRISTOL-MYERS SQUIBB PHARMA COMPANY (US) 2010-02-25 US disclosed
US-7655647-B2 Substituted lactams as inhibitors of Aβ protein production BRISTOL-MYERS SQUIBB PHARMA COMPANY (US) 2010-02-02 US disclosed
US-20100009966-A1 SUBSTITUTED LACTAMS AS INHIBITORS OF ABETA PROTEIN PRODUCTION BRISTOL-MYERS SQUIBB PHARMA COMPANY (US) 2010-01-14 US disclosed
US-20090170831-A1 SUBSTITUTED LACTAMS AS INHIBITORS OF ABETA PROTEIN PRODUCTION BRISTOL-MYERS SQUIBB PHARMA COMPANY (US) 2009-07-02 US disclosed
US-7498324-B2 Substituted lactams as inhibitors of Aβ protein production BRISTOL-MYERS SQUIBB PHARMA COMPANY (US) 2009-03-03 US disclosed
US-7276495-B2 Substituted lactams as inhibitors of Aβ protein production BRISTOL-MYERS SQUIBB PHARMA COMPANY (US) 2007-10-02 US disclosed
US-20070173491-A1 Substituted lactams as inhibitors of Abeta protein production BRISTOL-MYERS SQUIBB PHARMA COMPANY (US) 2007-07-26 US disclosed
US-20060211679-A1 Substituted lactams as inhibitors of Abeta protein production BRISTOL-MYERS SQUIBB PHARMA COMPANY (US) 2006-09-21 US disclosed
US-20050234039-A1 Prevent forming deposits of amyloid protein on nervous systems; Alzheimer's disease; Down syndrome HAN QI 2005-10-20 US disclosed
US-6900199-B2 Substituted lactams as inhibitors of Aβ protein production BRISTOL-MYERS SQUIBB PHARMA COMPANY (US) 2005-05-31 US disclosed
US-20040138201-A1 Substituted lactams as inhibitors of Abeta protein production HAN QI (US) 2004-07-15 US disclosed
US-6632812-B2 Alzheimer's disease; Down syndrom DUPONT PHARMACEUTICALS COMPANY 2003-10-14 US disclosed
US-20020025955-A1 Substituted lactams as inhibitors of A beta protein production BRISTOL-MYERS SQUIBB PHARMA COMPANY 2002-02-28 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 (10 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-20020025955-A1 Substituted lactams as inhibitors of A beta protein production BACE1, APP, APH1A NOTCH1 281/4885NOTCH3 902/4885PSEN1 6/4885
US-20100009966-A1 SUBSTITUTED LACTAMS AS INHIBITORS OF ABETA PROTEIN PRODUCTION BACE1, APP, APH1A NOTCH1 125/4885NOTCH3 468/4885PSEN1 6/4885
US-20100048541-A1 SUBSTITUTED LACTAMS AS INHIBITORS OF ABETA PROTEIN PRODUCTION BACE1, APP, APH1A NOTCH1 125/4885NOTCH3 468/4885PSEN1 6/4885
US-20090170831-A1 SUBSTITUTED LACTAMS AS INHIBITORS OF ABETA PROTEIN PRODUCTION BACE1, APP, APH1A NOTCH1 98/4885NOTCH3 283/4885PSEN1 6/4885
US-20040138201-A1 Substituted lactams as inhibitors of Abeta protein production BACE1, APP, APH1A NOTCH1 158/4885NOTCH3 650/4885PSEN1 6/4885
US-20060211679-A1 Substituted lactams as inhibitors of Abeta protein production BACE1, APP, APH1A NOTCH1 125/4885NOTCH3 468/4885PSEN1 6/4885
US-20070173491-A1 Substituted lactams as inhibitors of Abeta protein production BACE1, APP, APH1A NOTCH1 125/4885NOTCH3 468/4885PSEN1 6/4885
US-20100069373-A1 SUBSTITUTED LACTAMS AS INHIBITORS OF A BETA PROTEIN PRODUCTION BACE1, APP, BACE2 NOTCH1 167/4885NOTCH3 573/4885PSEN1 5/4885
US-20100056501-A1 SUBSTITUTED LACTAMS AS INHIBITORS OF ABETA PROTEIN PRODUCTION BACE1, APP, APH1A NOTCH1 125/4885NOTCH3 468/4885PSEN1 6/4885
US-20050234039-A1 Prevent forming deposits of amyloid protein on nervous systems; Alzheimer's disease; Down syndrome APP, BACE1, PSEN1 NOTCH1 147/4885NOTCH3 232/4885PSEN1 3/4885

“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.