SCHEMBL7327141

SCHEMBL7327141

CC(O)C#CCOc1ccc(S(=O)(=O)N2CC(=O)NC(C)C2C(=O)NO)cc1

nearest known ligand 0.60

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MMP13 P45452 16/20 0.60
ADAM17 P78536 18/20 0.51
MMP1 P03956 15/20 0.51
MMP9 P14780 10/20 0.51
MMP3 P08254 4/20 0.51

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
SCHEMBL7327463 0.92 MMP13 (0.59) MMP13ADAM17MMP1MMP9MMP3
SCHEMBL7326429 0.91 MMP13 (0.59) MMP13ADAM17MMP1MMP9MMP3
SCHEMBL7318761 0.91 MMP13 (0.61) MMP13ADAM17MMP1MMP9MMP3
SCHEMBL7322691 0.90 MMP13 (0.63) MMP13ADAM17MMP1MMP9MMP3
SCHEMBL7319812 0.89 MMP13 (0.64) MMP13ADAM17MMP1MMP9MMP3
SCHEMBL7318485 0.88 MMP13 (0.58) MMP13ADAM17MMP1MMP9MMP3
SCHEMBL7327796 0.88 MMP13 (0.63) MMP13ADAM17MMP1MMP9MMP3
SCHEMBL7322936 0.88 MMP13 (0.63) MMP13ADAM17MMP1MMP9MMP3
SCHEMBL7321311 0.87 MMP13 (0.61) MMP13ADAM17MMP1MMP9MMP3
SCHEMBL7317009 0.86 MMP13 (0.60) MMP13ADAM17MMP1MMP9MMP3

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
US-6387901-B1 ANTIINFLAMMATORY AGENTS; ANTICANCER AGENTS PFIZER INC 2002-05-14 US disclosed