SCHEMBL28707458

SCHEMBL28707458

O=C1C2CCC1CC(NS(=O)(=O)c1ccc(Oc3ccc(F)cc3)cc1)(C(=O)NO)C2

nearest known ligand 0.74

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 20/20 0.74
MMP13 P45452 20/20 0.74
MMP2 P08253 2/20 0.74
MMP3 P08254 2/20 0.74
MMP9 P14780 2/20 0.74
MMP8 P22894 2/20 0.74
MMP12 P39900 1/20 0.65
MMP14 P50281 1/20 0.65

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
SCHEMBL28707435 0.87 MMP1 (0.56) MMP1MMP13MMP2MMP3MMP9
SCHEMBL6994722 0.85 MMP1 (1.00) MMP1MMP13MMP2MMP3MMP9
SCHEMBL6996574 0.85 MMP1 (1.00) MMP1MMP13MMP2MMP3MMP9
SCHEMBL6994719 0.85 MMP1 (1.00) MMP1MMP13MMP2MMP3MMP9
SCHEMBL6962773 0.84 MMP1 (1.00) MMP1MMP13MMP2MMP3MMP9
SCHEMBL8496661 0.83 MMP1 (0.74) MMP1MMP13MMP2MMP3MMP9
SCHEMBL8492413 0.83 MMP1 (0.74) MMP1MMP13MMP2MMP3MMP9
SCHEMBL6964194 0.82 MMP1 (1.00) MMP1MMP13MMP2MMP3MMP9
SCHEMBL6960491 0.82 MMP1 (1.00) MMP1MMP13MMP2MMP3MMP9
SCHEMBL6958565 0.81 MMP1 (1.00) MMP1MMP13MMP2MMP3MMP9

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
CN-106999578-B Human monoclonal antibodies against EPHA4 and uses thereof 美国政府(由卫生和人类服务部的部长所代表) 2022-03-04 CN disclosed