SCHEMBL6971910

SCHEMBL6971910

Cc1cc(C2CCN(S(=O)(=O)C3(C(=O)O)CCOCC3)CC2)ccc1-c1cccc(OCCN)c1

nearest known ligand 0.63

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 11/20 0.63
MMP3 P08254 9/20 0.63
MMP9 P14780 3/20 0.54
MMP1 P03956 2/20 0.54
MMP14 P50281 2/20 0.54
FFAR1 O14842 2/20 0.35
EPHX1 P07099 1/20 0.35
MMP13 P45452 2/20 0.34
SUCNR1 Q9BXA5 3/20 0.33
PKM P14618 1/20 0.33
USP5 P45974 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
Hydrochloric Acid SCHEMBL6972622 0.93 MMP2 (0.62) MMP2MMP3MMP9MMP1MMP14
SCHEMBL6437469 0.92 MMP2 (0.63) MMP2MMP3MMP9MMP1MMP14
SCHEMBL6968408 0.92 MMP2 (0.67) MMP2MMP3MMP9MMP1MMP14
Hydrochloric Acid SCHEMBL6972714 0.91 MMP2 (0.66) MMP2MMP3MMP9MMP1MMP14
SCHEMBL6970701 0.91 MMP2 (0.60) MMP2MMP3MMP9MMP1MMP14
SCHEMBL6959909 0.89 MMP2 (0.51) MMP2MMP3MMP9MMP1MMP14
SCHEMBL6586243 0.89 MMP2 (0.49) MMP2MMP3MMP9MMP1MMP14
SCHEMBL6964268 0.88 MMP2 (0.53) MMP2MMP3MMP9MMP1MMP14
SCHEMBL6437467 0.87 MMP2 (0.51) MMP2MMP3MMP9MMP1MMP14
SCHEMBL6973195 0.87 MMP2 (0.53) MMP2MMP3MMP9MMP1MMP14

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-1181017-B1 METALLOPROTEASE INHIBITORS PFIZER LTD (GB) 2003-04-16 EP claimed