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SCHEMBL9505195

SCHEMBL9505195

CNC(=O)[C@H](CC(C)C)NC(=O)C(CC(C)C)CP(=O)(O)CNC(=O)[C@H](CCCCN1C(=O)c2ccccc2C1=O)NC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ MMP3 P08254 18/20 0.53
▸ MMP1 P03956 2/20 0.51
▸ MMP2 P08253 7/20 0.49

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
SCHEMBL9504991 0.92 MMP3 (0.45) MMP3MMP1MMP2
SCHEMBL9790846 0.91 MMP3 (0.60) MMP3MMP1MMP2
SCHEMBL9790866 0.91 MMP3 (0.60) MMP3MMP1MMP2
SCHEMBL9506080 0.87 MMP3 (0.67) MMP3MMP1MMP2
SCHEMBL9506066 0.87 MMP3 (0.67) MMP3MMP1MMP2
SCHEMBL9505069 0.86 MMP3 (0.62) MMP3MMP1MMP2
SCHEMBL9505079 0.86 MMP3 (0.62) MMP3MMP1MMP2
SCHEMBL9503957 0.84 MMP3 (0.52) MMP3MMP1MMP2
SCHEMBL9503950 0.82 MMP3 (0.51) MMP3MMP1MMP2
SCHEMBL9506811 0.82 MMP3 (0.51) MMP3MMP1MMP2

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-0276436-B1 PHOSPHINIC ACID DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 1993-06-16 — — EP disclosed
US-4885283-A Phosphinic acid derivatives HOFFMANN-LA ROCHE INC. (US) 1989-12-05 — — US disclosed