SCHEMBL8686191

SCHEMBL8686191

CCCCC(NCC(CC(C)C)NC(=O)c1cc(F)ccc1F)C(=O)CSCc1ccco1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PSMB5 P28074 2/20 0.37
PSMB11 A5LHX3 1/20 0.35
PSMA7 O14818 1/20 0.35
PSMB1 P20618 1/20 0.35
PSMA1 P25786 1/20 0.35
PSMA2 P25787 1/20 0.35
PSMA3 P25788 1/20 0.35
PSMA4 P25789 1/20 0.35
PSMB8 P28062 1/20 0.35
PSMB9 P28065 1/20 0.35
PSMA5 P28066 1/20 0.35
PSMB4 P28070 1/20 0.35
PSMB6 P28072 1/20 0.35
PSMB10 P40306 1/20 0.35
PSMB3 P49720 1/20 0.35
PSMB2 P49721 1/20 0.35
PSMA6 P60900 1/20 0.35
PSMA8 Q8TAA3 1/20 0.35
PSMB7 Q99436 1/20 0.35
ALDH1A1 P00352 7/20 0.35

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
SCHEMBL7311648 0.94 PSMB5 (0.37) PSMB5ALDH1A1POLBUSP2MAPT
SCHEMBL7311340 0.91 POLB (0.40) ALDH1A1POLBUSP2MAPTHSD17B10
SCHEMBL7311319 0.90 ALDH1A1 (0.37) ALDH1A1POLBUSP2MAPTHSD17B10
SCHEMBL7306114 0.89 ALDH1A1 (0.36) ALDH1A1POLBUSP2MAPTHSD17B10
SCHEMBL7313603 0.89 ALDH1A1 (0.40) ALDH1A1POLBUSP2MAPTHSD17B10
SCHEMBL7310588 0.88 HPGD (0.41) ALDH1A1POLBUSP2MAPTHSD17B10
SCHEMBL7310667 0.88 ALDH1A1 (0.39) ALDH1A1POLBUSP2MAPTHSD17B10
SCHEMBL7312708 0.88 ALDH1A1 (0.37) PSMB5ALDH1A1POLBUSP2MAPT
SCHEMBL7306338 0.88 ALDH1A1 (0.38) ALDH1A1POLBUSP2MAPTHSD17B10
SCHEMBL7310689 0.88 ALDH1A1 (0.35) ALDH1A1POLBUSP2MAPTHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5834508-A PROTEASE ENZYME INHIBITORS; MUSCLE DISORDERS MITSUBISHI CHEMICAL CORPORATION (JP) 1998-11-10 US disclosed
US-5639783-A POTENT PROTEASE INHIBITOR FOR TREATING MUSCULAR, NERVOUS SYSTEM DISEASES MITSUBISHI CHEMICAL CORPORATION (JP) 1997-06-17 US disclosed