SCHEMBL6240294

SCHEMBL6240294

Cc1ccc(C)c(COc2ccc(S(=O)(=O)N3C[C@H](C)OC(C)(C)[C@H]3OC(=O)NO)cc2)c1

nearest known ligand 0.53

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 16/20 0.53
ADAM17 P78536 12/20 0.50
MMP13 P45452 9/20 0.50
ADAMTS4 O75173 1/20 0.48

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
SCHEMBL6237348 0.87 MMP1 (0.62) MMP1ADAM17MMP13
SCHEMBL7765771 0.85 MMP1 (0.53) MMP1ADAM17MMP13ADAMTS4
SCHEMBL6236565 0.85 MMP1 (0.53) MMP1ADAM17MMP13ADAMTS4
SCHEMBL6239476 0.85 MMP1 (0.59) MMP1ADAM17MMP13
SCHEMBL6238120 0.84 ADAM17 (0.51) MMP1ADAM17MMP13ADAMTS4
SCHEMBL6239380 0.82 MMP1 (0.58) MMP1ADAM17MMP13
SCHEMBL6245036 0.82 MMP1 (0.57) MMP1ADAM17MMP13ADAMTS4
SCHEMBL6236825 0.79 ADAM17 (0.61) MMP1ADAM17MMP13
SCHEMBL7131939 0.79 ADAM17 (0.61) MMP1ADAM17MMP13
SCHEMBL6242757 0.76 MMP1 (0.59) MMP1ADAM17MMP13

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-1104412-B1 TACE INHIBITORS PFIZER PROD INC (US) 2005-06-15 EP claimed