Sugi Predict

Sugi Predict / Compounds / SCHEMBL7108965

SCHEMBL7108965

SCHEMBL7108965

Cc1ccccc1-c1ccc(/C=C/C[C@H](CC(=O)O)C(=O)N[C@H](C(=O)N[C@H](C)c2ccccc2)C(C)(C)C)cc1

nearest known ligand 0.55

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ MMP2 P08253 20/20 0.55
▸ MMP3 P08254 12/20 0.55
▸ BMP1 P13497 2/20 0.53
▸ MMP9 P14780 2/20 0.53
▸ MMP13 P45452 2/20 0.53
▸ MMP14 P50281 2/20 0.53
▸ MMP1 P03956 1/20 0.53

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
SCHEMBL7110227 0.91 MMP2 (0.55) MMP2MMP3BMP1MMP9MMP13
SCHEMBL7113032 0.91 MMP2 (0.55) MMP2MMP3BMP1MMP9MMP13
SCHEMBL7108971 0.90 MMP2 (0.58) MMP2MMP3BMP1MMP9MMP13
SCHEMBL7108961 0.90 MMP2 (0.58) MMP2MMP3BMP1MMP9MMP13
SCHEMBL7113031 0.87 MMP2 (0.59) MMP2MMP3BMP1MMP9MMP13
SCHEMBL7113038 0.87 MMP2 (0.59) MMP2MMP3BMP1MMP9MMP13
SCHEMBL7110225 0.84 MMP2 (0.59) MMP2MMP3BMP1MMP9MMP13
SCHEMBL7110231 0.84 MMP2 (0.59) MMP2MMP3BMP1MMP9MMP13
SCHEMBL7116158 0.83 MMP2 (0.43) MMP2MMP3MMP9MMP13MMP14
SCHEMBL7108968 0.83 MMP2 (0.55) MMP2MMP3BMP1MMP9MMP13

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