SCHEMBL6948348

SCHEMBL6948348

Cc1cccc2c1NC(=O)C(NC(=O)C1(NC(=O)CCC(C)C)CCCC1)N=C2C(C)(C)C

nearest known ligand 0.40

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
NOTCH1 P46531 18/20 0.40
RBPJ Q06330 5/20 0.40
NOTCH3 Q9UM47 13/20 0.40
KMT2A Q03164 1/20 0.32

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
SCHEMBL6954233 0.88 NOTCH1 (0.35) NOTCH1RBPJNOTCH3
SCHEMBL13502693 0.87 CCKBR (0.42) NOTCH1RBPJNOTCH3
SCHEMBL6949634 0.87 NOTCH1 (0.39) NOTCH1RBPJNOTCH3KMT2A
SCHEMBL3589772 0.79 PSEN1 (0.50)
SCHEMBL6948349 0.78 CCKBR (0.39) NOTCH1RBPJNOTCH3
SCHEMBL3594079 0.76 PSEN1 (0.40) NOTCH1RBPJKMT2A
SCHEMBL6952065 0.75 CCKBR (0.34) NOTCH1NOTCH3KMT2A
SCHEMBL6954236 0.75 CCKAR (0.38) NOTCH1RBPJNOTCH3
SCHEMBL6955221 0.71 NOTCH1 (0.49) NOTCH1RBPJNOTCH3
SCHEMBL13502688 0.69 PSEN1 (0.46) KMT2A

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-1268433-A1 CYCLIC LACTAMS AS INHIBITORS OF A-BETA-PROTEIN PRODUCTION Bristol-Myers Squibb Pharma Company (US) 2003-01-02 EP claimed
WO-2001074783-A1 CYCLIC LACTAMS AS INHIBITORS OF A ΒΕΤΑ PROTEIN PRODUCTION DUPONT PHARMACEUTICALS COMPANY (US) 2001-10-11 WO claimed
EP-1268433-A1 CYCLIC LACTAMS AS INHIBITORS OF A-BETA-PROTEIN PRODUCTION Bristol-Myers Squibb Pharma Company (US) 2003-01-02 EP disclosed
WO-2001074783-A1 CYCLIC LACTAMS AS INHIBITORS OF A ΒΕΤΑ PROTEIN PRODUCTION DUPONT PHARMACEUTICALS COMPANY (US) 2001-10-11 WO disclosed