SCHEMBL7112575

SCHEMBL7112575

Cc1cccc(-c2ccccc2CCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](CO)c2ccccc2)C(C)(C)C)[C@@H]2OC(C)(C)OC2=O)c1

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 20/20 0.40
MMP3 P08254 13/20 0.40
MMP9 P14780 5/20 0.40
MMP14 P50281 5/20 0.40
MMP13 P45452 3/20 0.40
MMP1 P03956 3/20 0.39
BMP1 P13497 1/20 0.36

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
SCHEMBL7116159 0.93 MMP2 (0.48) MMP2MMP3MMP9MMP14MMP13
SCHEMBL7108065 0.92 MMP2 (0.46) MMP2MMP3MMP9MMP14MMP13
SCHEMBL7701844 0.92 MMP2 (0.46) MMP2MMP3MMP9MMP14MMP13
SCHEMBL7110097 0.90 MMP2 (0.35) MMP2MMP3MMP9MMP14MMP13
SCHEMBL7109657 0.86 MMP2 (0.41) MMP2MMP3MMP9MMP14MMP13
SCHEMBL7111450 0.86 MMP2 (0.40) MMP2MMP3MMP9MMP14MMP13
SCHEMBL7112570 0.85 MMP2 (0.57) MMP2MMP3MMP9MMP14MMP13
SCHEMBL7112572 0.84 MMP2 (0.47) MMP2MMP3MMP9MMP14MMP13
SCHEMBL7110247 0.82 LMNA (0.35) MMP2MMP3
SCHEMBL7116148 0.79 MMP2 (0.68) MMP2MMP3MMP9MMP14MMP13

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1047665-B1 MATRIX METALLOPROTEASE INHIBITORS PFIZER LTD (GB) 2003-10-22 EP disclosed
US-6350907-B1 PEPTIDE ENZYME INHIBITORS PFIZER INC 2002-02-26 US disclosed