SCHEMBL7004672

SCHEMBL7004672

NC(=O)c1ccc(Oc2ccc(N3C4(CCS3(=O)=O)C(=O)NC(=O)NC4=O)cn2)cc1

nearest known ligand 0.75

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MMP13 P45452 18/20 0.75
MMP2 P08253 2/20 0.41
MMP3 P08254 2/20 0.41
MMP9 P14780 2/20 0.41
OPRM1 P35372 1/20 0.38
OPRD1 P41143 1/20 0.38
OPRK1 P41145 1/20 0.38
CHEK2 O96017 1/20 0.37

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
SCHEMBL6324971 0.86 MMP13 (1.00) MMP13
SCHEMBL6331916 0.83 MMP13 (0.76) MMP13MMP2MMP3MMP9
SCHEMBL6325572 0.83 MMP13 (0.76) MMP13MMP2MMP3MMP9
SCHEMBL6327805 0.82 MMP13 (0.68) MMP13MMP2MMP3MMP9
SCHEMBL6333972 0.81 MMP13 (0.90) MMP13
SCHEMBL6326016 0.79 MMP13 (0.64) MMP13OPRM1
SCHEMBL6326080 0.79 MMP13 (0.69) MMP13
SCHEMBL6326022 0.78 MMP13 (0.69) MMP13MMP2MMP3MMP9
SCHEMBL6325322 0.78 MMP13 (0.69) MMP13MMP2MMP3MMP9
SCHEMBL6401032 0.77 MMP13 (0.67) MMP13MMP2MMP3MMP9

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-1332146-A2 SPIRO-PYRIMIDINE-2,4,6-TRIONE METALLOPROTEINASE INHIBITORS Pfizer Products Inc. (US) 2003-08-06 EP disclosed
WO-2002034753-A2 SPIRO-PYRIMIDINE-2,4,6-TRIONE METALLOPROTEINASE INHIBITORS PFIZER PRODUCTS INC. (US) 2002-05-02 WO disclosed