SCHEMBL7428720

SCHEMBL7428720

CCOC(=O)CNC(Cc1ccccc1)C(=O)OC(C)(C)C

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ITGA4 P13612 2/20 0.59
ITGB7 P26010 2/20 0.59
PPID Q08752 1/20 0.51
MAPT P10636 4/20 0.49
TDP1 Q9NUW8 4/20 0.49
GPR142 Q7Z601 1/20 0.49
POLB P06746 1/20 0.49
CTSS P25774 2/20 0.46
CTSL P07711 1/20 0.46
CTSB P07858 1/20 0.46
CTSK P43235 1/20 0.46
MMP1 P03956 1/20 0.46
MMP3 P08254 1/20 0.46
MMP9 P14780 1/20 0.46
KDM4E B2RXH2 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
TSHR P16473 1/20 0.45
MMP8 P22894 1/20 0.45
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 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
SCHEMBL7428724 1.00 ITGA4 (0.59) ITGA4ITGB7PPIDMAPTTDP1
SCHEMBL6428127 0.91 ITGA4 (0.62) ITGA4ITGB7MAPTTDP1POLB
SCHEMBL7432428 0.90 ITGA4 (0.50) ITGA4ITGB7MMP9MMP8
SCHEMBL7432421 0.90 ITGA4 (0.50) ITGA4ITGB7MMP9MMP8
SCHEMBL7439396 0.90 ITGA4 (0.53) ITGA4ITGB7PPIDMAPTTDP1
SCHEMBL7439390 0.90 ITGA4 (0.53) ITGA4ITGB7PPIDMAPTTDP1
SCHEMBL6600210 0.90 ITGA4 (0.53) ITGA4ITGB7PPIDMAPTTDP1
SCHEMBL17287421 0.88 PPID (0.54) PPIDGPR142POLBMMP8MEN1
SCHEMBL2896038 0.87 MEN1 (0.57) PPIDGPR142POLBTSHRMMP8
SCHEMBL2896037 0.87 MEN1 (0.57) PPIDGPR142POLBTSHRMMP8

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
EP-0640594-A1 Hydantoin derivative as metalloprotease inhibitor FUJIREBIO INC. (JP) 1995-03-01 EP disclosed