SCHEMBL8000367

SCHEMBL8000367

CCCc1ccc(-c2ccc(CCC[C@H](CC(=O)NO)C(=O)N[C@@H](Cc3c[nH]c4ccccc34)C(=O)NCCc3ccccc3)cc2)cc1

nearest known ligand 0.67

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MMP8 P22894 10/20 0.67
MMP9 P14780 9/20 0.67
MMP2 P08253 8/20 0.67
MMP1 P03956 11/20 0.62
MMP7 P09237 1/20 0.62
LTA4H P09960 1/20 0.58
MMP3 P08254 1/20 0.57

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
SCHEMBL7997643 0.96 MMP8 (0.69) MMP8MMP9MMP2MMP1MMP7
SCHEMBL8003951 0.93 MMP8 (0.66) MMP8MMP9MMP2MMP1MMP7
SCHEMBL7995498 0.93 MMP2 (0.62) MMP8MMP9MMP2MMP1MMP7
SCHEMBL8000473 0.93 MMP8 (0.71) MMP8MMP9MMP2MMP1MMP7
SCHEMBL7999755 0.93 MMP8 (0.65) MMP8MMP9MMP2MMP1MMP7
SCHEMBL8001883 0.91 MMP8 (0.65) MMP8MMP9MMP2MMP1MMP7
SCHEMBL7998161 0.90 MMP8 (0.62) MMP8MMP9MMP2MMP1MMP7
SCHEMBL7997681 0.89 NMBR (0.54) MMP8MMP9MMP2MMP1
SCHEMBL8000362 0.89 BRS3 (0.61) MMP8MMP9MMP2MMP1MMP3
SCHEMBL8000309 0.88 MMP8 (0.65) MMP8MMP9MMP2MMP1MMP7

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
WO-2009113320-A1 MMP INHIBITOR 株式会社ヤクルト本社 (JP) 2009-09-17 WO disclosed