SCHEMBL6964268

SCHEMBL6964268

Cc1cc(C2CCN(S(=O)(=O)C3(C(=O)O)CCOCC3)CC2)ccc1-c1cccc(OCCNCc2ccccc2)c1

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 8/20 0.53
MMP3 P08254 8/20 0.53
MMP1 P03956 2/20 0.52
MMP9 P14780 2/20 0.52
MMP14 P50281 2/20 0.52
FFAR1 O14842 2/20 0.38
DRD2 P14416 3/20 0.38
DRD3 P35462 3/20 0.38
DRD4 P21917 2/20 0.38
KDM4E B2RXH2 1/20 0.37
MAPK1 P28482 1/20 0.37
VSIR Q9H7M9 1/20 0.36
ADRA1D P25100 1/20 0.36
ADRA1A P35348 1/20 0.36
ADRA1B P35368 1/20 0.36
FFAR4 Q5NUL3 1/20 0.34

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
SCHEMBL6964787 0.94 MMP2 (0.52) MMP2MMP3MMP1MMP9MMP14
SCHEMBL6964791 0.92 MMP2 (0.51) MMP2MMP3MMP1MMP9MMP14
SCHEMBL6971910 0.88 MMP2 (0.63) MMP2MMP3MMP1MMP9MMP14
SCHEMBL6966018 0.86 MMP2 (0.56) MMP2MMP3MMP1MMP9MMP14
SCHEMBL6959909 0.86 MMP2 (0.51) MMP2MMP3MMP1MMP9MMP14
SCHEMBL6586243 0.84 MMP2 (0.49) MMP2MMP3MMP1MMP9MMP14
SCHEMBL7129632 0.84 MMP2 (0.52) MMP2MMP3MMP1MMP9MMP14
SCHEMBL6437467 0.83 MMP2 (0.51) MMP2MMP3MMP1MMP9MMP14
SCHEMBL6973195 0.83 MMP2 (0.53) MMP2MMP3MMP1MMP9MMP14
SCHEMBL6433679 0.83 MMP2 (0.51) 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