SCHEMBL7011891

SCHEMBL7011891

CC(C)CC(C(=O)N(C)C1N=C(c2ccc(Cl)cc2)c2ccccc2NC1=O)C1(C(N)=O)CCC1

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CCKBR P32239 9/20 0.44
CCKAR P32238 5/20 0.44
CHRM1 P11229 1/20 0.38
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
ALDH1A1 P00352 1/20 0.37
NOTCH1 P46531 2/20 0.36
RBPJ Q06330 1/20 0.36
NOTCH3 Q9UM47 1/20 0.36
LMNA P02545 1/20 0.36
ALB P02768 1/20 0.36

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
SCHEMBL7003908 0.98 CCKBR (0.44) CCKBRCCKARCHRM1MEN1KMT2A
SCHEMBL7009892 0.98 CCKBR (0.43) CCKBRCCKARCHRM1MEN1KMT2A
SCHEMBL7012796 0.92 CCKBR (0.44) CCKBRCCKARCHRM1MEN1KMT2A
SCHEMBL7008743 0.88 CCKAR (0.44) CCKBRCCKARMEN1KMT2AALDH1A1
SCHEMBL7005901 0.82 CCKAR (0.44) CCKBRCCKARMEN1KMT2AALDH1A1
SCHEMBL7012788 0.75 PSEN1 (0.37) CCKBRCCKARCHRM1MEN1KMT2A
SCHEMBL7013368 0.74 CCKBR (0.49) CCKBRCCKARMEN1KMT2AALDH1A1
SCHEMBL4160420 0.73 NOTCH1 (0.65) CCKBRCCKARNOTCH1RBPJNOTCH3
SCHEMBL7007597 0.72 CCKBR (0.43) CCKBRCCKAR
SCHEMBL13904790 0.71 NOTCH1 (0.65) CCKBRCCKARNOTCH1RBPJNOTCH3

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
EP-1268450-A1 LACTAMS SUBSTITUTED BY CYCLIC SUCCINATES AS INHIBITORS OF A-BETA PROTEIN PRODUCTION Bristol-Myers Squibb Pharma Company (US) 2003-01-02 EP claimed
WO-2001092235-A1 LACTAMS SUBSTITUTED BY CYCLIC SUCCINATES AS INHIBITORS OF Aβ PROTEIN PRODUCTION BRISTOL-MYERS SQUIBB PHARMA COMPANY (US) 2001-12-06 WO claimed
EP-1268450-A1 LACTAMS SUBSTITUTED BY CYCLIC SUCCINATES AS INHIBITORS OF A-BETA PROTEIN PRODUCTION Bristol-Myers Squibb Pharma Company (US) 2003-01-02 EP disclosed
WO-2001092235-A1 LACTAMS SUBSTITUTED BY CYCLIC SUCCINATES AS INHIBITORS OF Aβ PROTEIN PRODUCTION BRISTOL-MYERS SQUIBB PHARMA COMPANY (US) 2001-12-06 WO disclosed