SCHEMBL5167695

SCHEMBL5167695

COc1cccc(-c2ccc(S(=O)(=O)NC3CCN(C(C)C(=O)N4CCCCC4)C3=O)s2)c1

nearest known ligand 0.58

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
F10 P00742 19/20 0.58
MMP1 P03956 1/20 0.46
MMP13 P45452 1/20 0.46

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
SCHEMBL5141826 1.00 F10 (0.58) F10MMP1MMP13
SCHEMBL5142888 0.90 F10 (0.65) F10
SCHEMBL5142803 0.89 F10 (0.59) F10
SCHEMBL5143463 0.89 F10 (0.64) F10
SCHEMBL5143050 0.86 F10 (0.64) F10MMP1MMP13
SCHEMBL5143120 0.86 F10 (0.64) F10
SCHEMBL5172890 0.86 F10 (0.64) F10MMP1MMP13
SCHEMBL5146306 0.85 F10 (0.68) F10
SCHEMBL5143418 0.83 F10 (0.62) F10
SCHEMBL5144955 0.82 F10 (0.63) F10

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1839659-A2 Chemicals compounds GLAXO GROUP LIMITED (GB) 2007-10-03 EP disclosed