SCHEMBL7424316

SCHEMBL7424316

COc1ccc(S(=O)(=O)N2CC=CCC(CO)C2C(=O)O)cc1

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MMP3 P08254 14/20 0.48
MMP1 P03956 11/20 0.48
MMP9 P14780 10/20 0.48
MMP2 P08253 3/20 0.48
MMP13 P45452 1/20 0.48
MMP7 P09237 4/20 0.44
ADAM17 P78536 5/20 0.43
MMP8 P22894 4/20 0.43
MMP12 P39900 1/20 0.42
HTT P42858 1/20 0.42

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
SCHEMBL7423215 0.88 MMP3 (0.61) MMP3MMP1MMP9MMP2MMP13
SCHEMBL7426986 0.87 MMP3 (0.42) MMP3MMP1MMP9MMP2MMP13
SCHEMBL7427472 0.84 MMP1 (0.48) MMP3MMP1MMP9MMP2MMP13
SCHEMBL6076031 0.84 MMP3 (0.47) MMP3MMP1MMP9MMP2MMP13
SCHEMBL7417107 0.84 MMP1 (0.56) MMP3MMP1MMP9MMP2MMP13
SCHEMBL8155835 0.83 MMP1 (0.47) MMP3MMP1MMP9MMP2MMP13
SCHEMBL6076126 0.81 MMP3 (0.47) MMP3MMP1MMP9MMP2MMP13
SCHEMBL6075691 0.80 MMP3 (0.49) MMP3MMP1MMP9MMP2MMP13
SCHEMBL6075406 0.80 MMP3 (0.46) MMP3MMP1MMP9MMP2MMP13
SCHEMBL7389960 0.80 MMP1 (0.57) MMP3MMP1MMP9MMP2MMP13

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-1040099-A1 AZEPINE OR LARGER MEDIUM RING DERIVATIVES AND THEIR USE AS PHARMACEUTICALS Amgen Inc., (US) 2000-10-04 EP disclosed
US-6107291-A ANTIINFLAMMATORY AGENT AMGEN INC. (US) 2000-08-22 US disclosed
WO-1999032451-A1 AZEPINE OR LARGER MEDIUM RING DERIVATIVES AND THEIR USE AS PHARMACEUTICALS AMGEN INC. (US) 1999-07-01 WO disclosed