SCHEMBL7340628

SCHEMBL7340628

CC(=O)c1ccc(NC(=O)[C@H](Cc2ccc(OCc3ccccc3)cc2)NC(=O)[C@H](CC(C)C)NC(=O)N2CCCCCC2)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CACNA1B Q00975 7/20 0.59
PSMB11 A5LHX3 12/20 0.57
PSMA7 O14818 12/20 0.57
PSMB1 P20618 12/20 0.57
PSMA1 P25786 12/20 0.57
PSMA2 P25787 12/20 0.57
PSMA3 P25788 12/20 0.57
PSMA4 P25789 12/20 0.57
PSMB8 P28062 12/20 0.57
PSMB9 P28065 12/20 0.57
PSMA5 P28066 12/20 0.57
PSMB4 P28070 12/20 0.57
PSMB6 P28072 12/20 0.57
PSMB5 P28074 12/20 0.57
PSMB10 P40306 12/20 0.57
PSMB3 P49720 12/20 0.57
PSMB2 P49721 12/20 0.57
PSMA6 P60900 12/20 0.57
PSMA8 Q8TAA3 12/20 0.57
PSMB7 Q99436 12/20 0.57

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
SCHEMBL7346144 0.94 CACNA1B (0.60) CACNA1BPSMB11PSMA7PSMB1PSMA1
SCHEMBL7343485 0.92 PSMB8 (0.65) CACNA1BPSMB11PSMA7PSMB1PSMA1
SCHEMBL7347713 0.92 CACNA1B (0.59) CACNA1BPSMB11PSMA7PSMB1PSMA1
SCHEMBL7338861 0.91 CACNA1B (0.59) CACNA1BPSMB11PSMA7PSMB1PSMA1
SCHEMBL7344689 0.91 CACNA1B (0.59) CACNA1BPSMB11PSMA7PSMB1PSMA1
SCHEMBL7340693 0.91 CACNA1B (0.58) CACNA1BPSMB11PSMA7PSMB1PSMA1
SCHEMBL7336922 0.90 CACNA1B (0.62) CACNA1BPSMB11PSMA7PSMB1PSMA1
SCHEMBL7336499 0.87 CACNA1B (0.56) CACNA1BPSMB11PSMA7PSMB1PSMA1
SCHEMBL7345344 0.86 PSMB5 (0.59) CACNA1BPSMB11PSMA7PSMB1PSMA1
SCHEMBL7339830 0.86 CACNA1B (0.68) CACNA1BPSMB11PSMA7PSMB1PSMA1

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