SCHEMBL7684559

SCHEMBL7684559

O=C(O)CC(NS(=O)(=O)c1ccc(F)cc1)C(=O)Cn1nnc(Cc2c(Cl)cccc2Cl)n1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 10/20 0.39
MMP13 P45452 4/20 0.39
MMP1 P03956 3/20 0.39
MMP3 P08254 3/20 0.39
MMP9 P14780 8/20 0.38
MMP8 P22894 3/20 0.38
MMP12 P39900 2/20 0.38
MMP14 P50281 2/20 0.38
L3MBTL1 Q9Y468 1/20 0.37
ADAMTS4 O75173 2/20 0.36
MMP7 P09237 2/20 0.36
ADAMTS5 Q9UNA0 1/20 0.36
CNR2 P34972 2/20 0.36
ALDH1A1 P00352 1/20 0.35
LMNA P02545 1/20 0.35
RECQL P46063 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
SLC1A3 P43003 1/20 0.35
SLC1A2 P43004 1/20 0.35
SLC1A1 P43005 1/20 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
SCHEMBL7683595 0.93 MMP2 (0.44) MMP2MMP13MMP1MMP3MMP9
SCHEMBL7686355 0.93 MMP9 (0.44) MMP2MMP13MMP9MMP8MMP12
SCHEMBL7678024 0.93 CNR2 (0.40) MMP2MMP13MMP9MMP8MMP12
SCHEMBL7686196 0.92 MMP2 (0.38) MMP2MMP13MMP1MMP3MMP9
SCHEMBL7687017 0.91 MMP2 (0.39) MMP2MMP13MMP9MMP8MMP12
SCHEMBL7682261 0.91 ALDH1A1 (0.37) MMP2MMP13MMP1MMP3MMP9
SCHEMBL7679666 0.91 MMP9 (0.43) MMP2MMP13MMP1MMP3MMP9
SCHEMBL7686108 0.91 MMP2 (0.42) MMP2MMP13MMP1MMP3MMP9
SCHEMBL7686407 0.91 EEF2K (0.45) MMP2MMP13MMP1MMP3MMP9
SCHEMBL7686256 0.90 MMP9 (0.40) MMP2MMP13MMP1MMP3MMP9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6136834-A TETRAZOLE PEPTIDES ONO PHARMACEUTICAL CO., LTD. (JP) 2000-10-24 US claimed
EP-0900791-A1 TETRAZOLE DERIVATIVES AND DRUGS CONTAINING THE SAME AS THE ACTIVE INGREDIENT ONO PHARMACEUTICAL CO., LTD. (JP) 1999-03-10 EP claimed
US-6376484-B1 FOR PREVENTION AND/OR TREATMENT OF VARIOUS KINDS OF INFLAMMATORY DISEASE ONO PHARMACEUTICAL CO., LTD. (JP) 2002-04-23 US disclosed
US-6136834-A TETRAZOLE PEPTIDES ONO PHARMACEUTICAL CO., LTD. (JP) 2000-10-24 US disclosed
EP-0900791-A1 TETRAZOLE DERIVATIVES AND DRUGS CONTAINING THE SAME AS THE ACTIVE INGREDIENT ONO PHARMACEUTICAL CO., LTD. (JP) 1999-03-10 EP disclosed