SCHEMBL7347240

SCHEMBL7347240

CC(C)C[C@H](NC(=O)N1CCCCCC1)C(=O)N[C@@H](Cc1ccc(C=CC2(O)CCCCC2)cc1)C(=O)NC(C)(C)C

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CACNA1B Q00975 3/20 0.45
PSMB8 P28062 13/20 0.42
PSMB9 P28065 13/20 0.42
PSMB5 P28074 13/20 0.42
PSMB10 P40306 13/20 0.42
PSMB2 P49721 13/20 0.42
PSMB11 A5LHX3 12/20 0.42
PSMA7 O14818 12/20 0.42
PSMB1 P20618 12/20 0.42
PSMA1 P25786 12/20 0.42
PSMA2 P25787 12/20 0.42
PSMA3 P25788 12/20 0.42
PSMA4 P25789 12/20 0.42
PSMA5 P28066 12/20 0.42
PSMB4 P28070 12/20 0.42
PSMB6 P28072 12/20 0.42
PSMB3 P49720 12/20 0.42
PSMA6 P60900 12/20 0.42
PSMA8 Q8TAA3 12/20 0.42
PSMB7 Q99436 12/20 0.42

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
SCHEMBL7339756 0.87 CACNA1B (0.54) CACNA1BPSMB8PSMB9PSMB5PSMB10
SCHEMBL7348626 0.85 MMP1 (0.43) CACNA1BPSMB5MMP1MMP2MMP3
SCHEMBL7345997 0.84 CACNA1B (0.46) CACNA1BPSMB8PSMB9PSMB5PSMB10
SCHEMBL7344938 0.84 CACNA1B (0.47) CACNA1BPSMB8PSMB9PSMB5PSMB10
SCHEMBL7348732 0.82 CACNA1B (0.51) CACNA1BPSMB8PSMB9PSMB5PSMB10
SCHEMBL7337684 0.82 CACNA1B (0.51) CACNA1BPSMB8PSMB9PSMB5PSMB10
SCHEMBL7345058 0.82 CACNA1B (0.51) CACNA1BPSMB8PSMB9PSMB5PSMB10
SCHEMBL7338306 0.81 CACNA1B (0.56) CACNA1BPSMB8PSMB9PSMB5PSMB10
SCHEMBL7345978 0.81 CACNA1B (0.56) CACNA1BPSMB8PSMB9PSMB5PSMB10
SCHEMBL7339612 0.79 CACNA1B (0.49) 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