SCHEMBL6691928

SCHEMBL6691928

O=C(NO)O[C@@H]1CN(Cc2ccc(OCc3ccc(F)cc3Cl)cc2)C(=O)N1

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MMP13 P45452 10/20 0.48
MMP1 P03956 8/20 0.48
MMP2 P08253 6/20 0.48
MMP3 P08254 3/20 0.48
MMP9 P14780 3/20 0.48
ADAM17 P78536 3/20 0.47
ADAMTS5 Q9UNA0 6/20 0.46
ADAMTS4 O75173 3/20 0.46
MMP14 P50281 2/20 0.46
ADAMTS1 Q9UHI8 2/20 0.45
TNF P01375 1/20 0.45
MMP8 P22894 1/20 0.45
S1PR1 P21453 1/20 0.44
LTK P29376 1/20 0.44
TAOK1 Q7L7X3 1/20 0.44
S1PR5 Q9H228 1/20 0.44
ADAMTS7 Q9UKP4 4/20 0.42
P2RX7 Q99572 1/20 0.39

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
SCHEMBL6692364 0.85 MMP13 (0.68) MMP13MMP1MMP2MMP3MMP9
SCHEMBL6697906 0.82 MMP13 (0.69) MMP13MMP1MMP2MMP3MMP9
SCHEMBL6691033 0.81 MMP13 (0.70) MMP13MMP1MMP2MMP3MMP9
SCHEMBL6690792 0.80 MMP13 (0.66) MMP13MMP1MMP2MMP3MMP9
SCHEMBL6693302 0.77 MMP13 (0.55) MMP13MMP1MMP2MMP3MMP9
SCHEMBL6689092 0.77 MMP13 (0.67) MMP13MMP1MMP2MMP3MMP9
SCHEMBL6690704 0.76 MMP13 (0.72) MMP13MMP1MMP2MMP3MMP9
SCHEMBL7624130 0.74 P2RX7 (0.55) MMP13MMP1MMP2MMP3MMP9
SCHEMBL6691208 0.74 MMP1 (0.53) MMP13MMP1MMP2MMP3MMP9
SCHEMBL6693818 0.73 MMP13 (0.71) MMP13MMP1MMP2MMP3MMP9

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-1134215-B1 2-oxo-imidazolidine-4-carboxylic acid hydroxamine compounds that inhibit matrix metalloproteinases PFIZER PROD INC (US) 2004-10-06 EP claimed