SCHEMBL7849941

SCHEMBL7849941

CC(C)C[C@@H](C(=O)Nn1c(=O)[nH]n(C)c1=O)[C@H](CCCc1ccccc1)C(=O)NOCc1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 2/20 0.40
MMP13 P45452 1/20 0.40
ECE1 P42892 1/20 0.37
MMP3 P08254 3/20 0.36
MMP8 P22894 3/20 0.34
CTSL P07711 5/20 0.34
CTSB P07858 1/20 0.34
MMP2 P08253 2/20 0.33
FCER2 P06734 1/20 0.33
HPGD P15428 1/20 0.33
MMP9 P14780 1/20 0.33
MMP7 P09237 1/20 0.33
CA5A P35218 1/20 0.33
MMP14 P50281 1/20 0.33

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
SCHEMBL7849943 1.00 MMP1 (0.40) MMP1MMP13ECE1MMP3MMP8
SCHEMBL7946534 1.00 MMP1 (0.40) MMP1MMP13ECE1MMP3MMP8
SCHEMBL7847162 0.88 MMP1 (0.47) MMP1MMP13MMP3MMP8MMP2
SCHEMBL7847158 0.88 MMP1 (0.47) MMP1MMP13MMP3MMP8MMP2
SCHEMBL7946725 0.86 MMP1 (0.42) MMP1MMP13ECE1MMP3MMP8
SCHEMBL7946723 0.86 MMP1 (0.42) MMP1MMP13ECE1MMP3MMP8
SCHEMBL7844907 0.82 L3MBTL1 (0.43) MMP1MMP13ECE1MMP3MMP8
SCHEMBL7844905 0.82 L3MBTL1 (0.43) MMP1MMP13ECE1MMP3MMP8
SCHEMBL7841798 0.80 MMP1 (0.41) MMP1MMP13ECE1MMP3MMP8
SCHEMBL7953838 0.80 MMP1 (0.41) MMP1MMP13ECE1MMP3MMP8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1137640-A1 CYCLIC HYDRAZINE DERIVATIVES AS TNF-ALPHA INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2001-10-04 EP disclosed
US-6281363-B1 ANTIINFLAMMATORY AGENTS; ANTIARTHRITIC AGENTS; AUTOIMMUNE DISORDERS HOFFMANN-LA ROCHE INC. 2001-08-28 US disclosed
WO-2000035885-A1 CYCLIC HYDRAZINE DERIVATIVES AS TNF-ALPHA INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2000-06-22 WO disclosed