SCHEMBL6201793

SCHEMBL6201793

N#Cc1ccc(-c2cc(-c3ccc(Oc4ccc(N5CCCC56C(=O)NC(=O)NC6=O)cn4)cc3)on2)nc1

nearest known ligand 0.66

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MMP13 P45452 17/20 0.66
CXCR1 P25024 1/20 0.33
SCD5 Q86SK9 1/20 0.33

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
SCHEMBL6204073 0.94 MMP13 (0.68) MMP13CXCR1SCD5
SCHEMBL6204266 0.93 MMP13 (0.73) MMP13CXCR1
SCHEMBL6202352 0.93 MMP13 (0.73) MMP13CXCR1
SCHEMBL6205587 0.87 MMP13 (0.69) MMP13
SCHEMBL6203135 0.87 MMP13 (0.70) MMP13
SCHEMBL6202336 0.87 MMP13 (0.72) MMP13
SCHEMBL6202145 0.86 MMP13 (0.60) MMP13CXCR1
SCHEMBL6203616 0.86 MMP13 (0.71) MMP13
SCHEMBL6203917 0.86 MMP13 (0.65) MMP13
SCHEMBL6204843 0.85 MMP13 (0.73) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1501834-B1 TRIARYL-OXY-ARYL-SPIRO-PYRIMIDINE-2, 4, 6-TRIONE METALLOPROTEINASE INHIBITORS PFIZER PROD INC (US) 2005-09-07 EP disclosed
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