SCHEMBL8843587

SCHEMBL8843587

C[N]Cc1ccccc1S(=O)(=O)c1ccc(OC)cc1

nearest known ligand 0.64

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 15/20 0.64
MMP12 P39900 15/20 0.64
MMP8 P22894 11/20 0.64
MMP13 P45452 11/20 0.64
MMP14 P50281 11/20 0.64
MMP16 P51512 11/20 0.64
MMP9 P14780 14/20 0.60
MMP3 P08254 8/20 0.60
MMP1 P03956 5/20 0.60
ADAM17 P78536 1/20 0.60
PKM P14618 2/20 0.51
PTGDR2 Q9Y5Y4 1/20 0.45
GAA P10253 1/20 0.45
HTR6 P50406 1/20 0.44

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
SCHEMBL8843421 0.85 MMP2 (0.64) MMP2MMP12MMP8MMP13MMP14
SCHEMBL7274484 0.84 MMP2 (0.71) MMP2MMP12MMP8MMP13MMP14
SCHEMBL10049385 0.81 MMP2 (0.73) MMP2MMP12MMP8MMP13MMP14
SCHEMBL13697346 0.76 MMP2 (0.67) MMP2MMP12MMP8MMP13MMP14
SCHEMBL8228783 0.75 MMP2 (1.00) MMP2MMP12MMP8MMP13MMP14
SCHEMBL8228874 0.75 MMP2 (1.00) MMP2MMP12MMP8MMP13MMP14
SCHEMBL8933453 0.74 PKM (0.62) MMP2MMP12MMP8MMP13MMP14
SCHEMBL931939 0.74 HTR6 (0.77) MMP2MMP12MMP8MMP13MMP14
SCHEMBL315452 0.74 MMP2 (0.86) MMP2MMP12MMP8MMP13MMP14
SCHEMBL315453 0.74 MMP2 (0.64) MMP2MMP12MMP8MMP13MMP14

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
US-5672615-A MATRIX-DEGRADING METALLOPROTEINASE INHIBITORS NOVARTIS CORPORATION (US) 1997-09-30 US disclosed