SCHEMBL6202907

SCHEMBL6202907

CN1C(=O)N(c2ccc(Oc3ccc(-c4nc(-c5ccc(C#N)cc5)co4)cc3)nc2)C2(C(=O)NC(=O)NC2=O)S1(=O)=O

nearest known ligand 0.66

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
MMP13 P45452 20/20 0.66

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
SCHEMBL6204999 0.86 MMP13 (0.71) MMP13
SCHEMBL6204315 0.85 MMP13 (0.65) MMP13
SCHEMBL6204178 0.82 MMP13 (0.75) MMP13
SCHEMBL6202556 0.80 MMP13 (0.77) MMP13
SCHEMBL6203744 0.79 MMP13 (1.00) MMP13
SCHEMBL6203076 0.79 MMP13 (1.00) MMP13
SCHEMBL6204082 0.79 MMP13 (0.95) MMP13
SCHEMBL6203330 0.79 MMP13 (0.76) MMP13
SCHEMBL6202403 0.78 MMP13 (0.94) MMP13
SCHEMBL6201690 0.75 MMP13 (0.76) MMP13

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-1501834-A1 TRIARYL-OXY-ARYL-SPIRO-PYRIMIDINE-2, 4, 6-TRIONE METALLOPROTEINASE INHIBITORS Pfizer Products Inc. (US) 2005-02-02 EP disclosed
WO-2003091259-A1 TRIARYL-OXY-ARYL-SPIRO-PYRIMIDINE-2, 4, 6-TRIONE METALLOPROTEINASE INHIBITORS PFIZER PRODUCTS INC. (US) 2003-11-06 WO disclosed