SCHEMBL7347369

SCHEMBL7347369

CC(C)C[C@H](NC(=O)N1CCCCCC1)C(=O)N[C@@H](Cc1ccc(C#CCN(C)C)cc1)C(=O)NC(C)(C)C

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CACNA1B Q00975 4/20 0.46
PSMB8 P28062 14/20 0.45
PSMB9 P28065 14/20 0.45
PSMB5 P28074 14/20 0.45
PSMB10 P40306 14/20 0.45
PSMB2 P49721 14/20 0.45
PSMB11 A5LHX3 13/20 0.45
PSMA7 O14818 13/20 0.45
PSMB1 P20618 13/20 0.45
PSMA1 P25786 13/20 0.45
PSMA2 P25787 13/20 0.45
PSMA3 P25788 13/20 0.45
PSMA4 P25789 13/20 0.45
PSMA5 P28066 13/20 0.45
PSMB4 P28070 13/20 0.45
PSMB6 P28072 13/20 0.45
PSMB3 P49720 13/20 0.45
PSMA6 P60900 13/20 0.45
PSMA8 Q8TAA3 13/20 0.45
PSMB7 Q99436 13/20 0.45

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
SCHEMBL7345205 0.88 CACNA1B (0.54) CACNA1BPSMB8PSMB9PSMB5PSMB10
SCHEMBL7343336 0.88 CACNA1B (0.48) CACNA1BPSMB8PSMB9PSMB5PSMB10
SCHEMBL7341953 0.85 CACNA1B (0.46) CACNA1BPSMB8PSMB9PSMB5PSMB10
SCHEMBL7341779 0.84 CACNA1B (0.47) CACNA1BPSMB8PSMB9PSMB5PSMB10
SCHEMBL7348732 0.83 CACNA1B (0.51) CACNA1BPSMB8PSMB9PSMB5PSMB10
SCHEMBL7337684 0.83 CACNA1B (0.51) CACNA1BPSMB8PSMB9PSMB5PSMB10
SCHEMBL7345058 0.82 CACNA1B (0.51) CACNA1BPSMB8PSMB9PSMB5PSMB10
SCHEMBL7346892 0.82 CACNA1B (0.47) CACNA1BPSMB8PSMB9PSMB5PSMB10
SCHEMBL7338306 0.82 CACNA1B (0.56) CACNA1BPSMB8PSMB9PSMB5PSMB10
SCHEMBL7345978 0.82 CACNA1B (0.56) CACNA1BPSMB8PSMB9PSMB5PSMB10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6423689-B1 Peptidyl calcium channel blockers WARNER-LAMBERT COMPANY 2002-07-23 US disclosed