SCHEMBL6970701

SCHEMBL6970701

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

nearest known ligand 0.60

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 9/20 0.60
MMP3 P08254 9/20 0.60
MMP1 P03956 2/20 0.52
MMP9 P14780 2/20 0.52
MMP14 P50281 2/20 0.52
HRH3 Q9Y5N1 2/20 0.33
SUCNR1 Q9BXA5 3/20 0.32
FFAR1 O14842 2/20 0.32
PKM P14618 1/20 0.32
USP5 P45974 1/20 0.31
HTR7 P34969 1/20 0.31
CHRM2 P08172 1/20 0.31
CHRM4 P08173 1/20 0.31
CHRM5 P08912 1/20 0.31
CHRM1 P11229 1/20 0.31
CHRM3 P20309 1/20 0.31

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
SCHEMBL6971910 0.91 MMP2 (0.63) MMP2MMP3MMP1MMP9MMP14
SCHEMBL6960736 0.90 MMP3 (0.49) MMP2MMP3MMP1MMP9MMP14
SCHEMBL6964791 0.88 MMP2 (0.51) MMP2MMP3MMP1MMP9MMP14
SCHEMBL6959536 0.88 MMP2 (0.51) MMP2MMP3MMP1MMP9MMP14
Hydrochloric Acid SCHEMBL6972622 0.86 MMP2 (0.62) MMP2MMP3MMP1MMP9MMP14
SCHEMBL6437469 0.85 MMP2 (0.63) MMP2MMP3MMP1MMP9MMP14
SCHEMBL6968408 0.85 MMP2 (0.67) MMP2MMP3MMP1MMP9MMP14
Hydrochloric Acid SCHEMBL6972714 0.84 MMP2 (0.66) MMP2MMP3MMP1MMP9MMP14
SCHEMBL6959909 0.81 MMP2 (0.51) MMP2MMP3MMP1MMP9MMP14
SCHEMBL6959958 0.81 MMP2 (0.60) MMP2MMP3MMP1MMP9MMP14

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