SCHEMBL328494

SCHEMBL328494

CN(CCN(CC(=O)NO)S(=O)(=O)c1cc(F)c(Oc2ccc(Cl)cc2)c(F)c1)S(=O)(=O)c1cccnc1O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP13 P45452 5/20 0.38
MMP1 P03956 4/20 0.38
MMP8 P22894 3/20 0.38
MMP9 P14780 3/20 0.38
MMP2 P08253 3/20 0.38
MMP7 P09237 2/20 0.38
MMP12 P39900 2/20 0.38
MMP14 P50281 2/20 0.38
MMP16 P51512 1/20 0.38
ALDH1A1 P00352 1/20 0.38
HPGD P15428 1/20 0.38
ALOX15 P16050 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
HSD17B10 Q99714 1/20 0.38
MEP1B Q16820 1/20 0.37
BMP1 P13497 1/20 0.37
MMP3 P08254 4/20 0.36
ADAM17 P78536 1/20 0.36
KMT2A Q03164 1/20 0.35
ADAMTS4 O75173 1/20 0.35

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
SCHEMBL6863163 0.87 MMP1 (0.44) MMP13MMP1MMP8MMP9MMP2
SCHEMBL328652 0.84 P2RX7 (0.40) MMP13MMP1MMP8MMP9MMP2
SCHEMBL328649 0.84 MMP1 (0.44) MMP13MMP1MMP8MMP9MMP2
SCHEMBL328545 0.84 HDAC6 (0.47) MMP13MMP1MMP8MMP9MMP2
SCHEMBL6864397 0.83 MMP1 (0.44) MMP13MMP1MMP8MMP9MMP2
SCHEMBL328654 0.82 MMP3 (0.36) MMP13MMP1MMP8MMP9MMP2
SCHEMBL328493 0.82 TDP1 (0.44) MMP13MMP1MMP8MMP9MMP2
SCHEMBL6864612 0.80 BMP1 (0.42) MMP13MMP1MMP8MMP9MMP2
SCHEMBL6865083 0.80 MMP1 (0.48) MMP13MMP1MMP8MMP9MMP2
SCHEMBL6850285 0.80 MMP13 (0.41) MMP13MMP1MMP8MMP9MMP2

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-2428509-A1 Human adam-10 inhibitors Symphony Evolution, Inc. (US) 2012-03-14 EP disclosed