SCHEMBL7013368

SCHEMBL7013368

CN(C(=O)C(CC1CC1)C1(C(N)=O)CC=CC1)C1N=C(c2ccccc2)c2ccccc2NC1=O

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CCKBR P32239 10/20 0.49
CCKAR P32238 8/20 0.49
MEN1 O00255 1/20 0.43
ALDH1A1 P00352 1/20 0.43
KMT2A Q03164 1/20 0.43
NOTCH1 P46531 2/20 0.39
RBPJ Q06330 2/20 0.39
HDAC1 Q13547 2/20 0.39
BACE1 P56817 1/20 0.38
HDAC3 O15379 1/20 0.37
HDAC6 Q9UBN7 1/20 0.37

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
SCHEMBL7006359 0.88 CCKBR (0.37) CCKBRCCKARMEN1ALDH1A1KMT2A
SCHEMBL7012796 0.82 CCKBR (0.44) CCKBRCCKARMEN1ALDH1A1KMT2A
SCHEMBL7005901 0.80 CCKAR (0.44) CCKBRCCKARMEN1ALDH1A1KMT2A
SCHEMBL7012788 0.76 PSEN1 (0.37) CCKBRCCKARMEN1KMT2A
SCHEMBL7003908 0.74 CCKBR (0.44) CCKBRCCKARMEN1ALDH1A1KMT2A
SCHEMBL7011891 0.74 CCKBR (0.44) CCKBRCCKARMEN1ALDH1A1KMT2A
SCHEMBL7006763 0.74 CCKBR (0.39) CCKBRCCKAR
SCHEMBL7009892 0.73 CCKBR (0.43) CCKBRCCKARMEN1ALDH1A1KMT2A
SCHEMBL7008743 0.72 CCKAR (0.44) CCKBRCCKARMEN1ALDH1A1KMT2A
SCHEMBL7007597 0.72 CCKBR (0.43) CCKBRCCKAR

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