SCHEMBL7359520

SCHEMBL7359520

CC(C(N)=O)N1CCC(C)(c2ccc(Oc3ccccc3)cc2)C1=O

nearest known ligand 0.76

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ADAM17 P78536 9/20 0.76
MMP1 P03956 8/20 0.76
MMP2 P08253 13/20 0.58
MMP9 P14780 13/20 0.58
MMP3 P08254 2/20 0.48
MMP8 P22894 2/20 0.48
MMP13 P45452 2/20 0.48
MMP7 P09237 1/20 0.48
MMP14 P50281 1/20 0.48
MMP15 P51511 1/20 0.48
MMP16 P51512 1/20 0.48
ADAM33 Q9BZ11 1/20 0.48
HRH3 Q9Y5N1 1/20 0.38

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
SCHEMBL7352853 0.91 ADAM17 (0.62) ADAM17MMP1MMP2MMP9MMP3
SCHEMBL7353080 0.86 MMP2 (0.61) ADAM17MMP1MMP2MMP9MMP3
SCHEMBL6627898 0.86 ADAM17 (1.00) ADAM17MMP1MMP2MMP9MMP3
SCHEMBL7351232 0.84 MMP2 (0.55) ADAM17MMP1MMP2MMP9MMP3
SCHEMBL7243883 0.81 ADAM17 (0.90) ADAM17MMP1MMP2MMP9MMP3
SCHEMBL7384101 0.80 MMP2 (0.51) ADAM17MMP1MMP2MMP9MMP3
SCHEMBL7355036 0.78 MMP2 (0.74) ADAM17MMP1MMP2MMP9MMP3
SCHEMBL7354605 0.78 MMP2 (0.59) ADAM17MMP1MMP2MMP9
SCHEMBL7360865 0.77 ADAM17 (0.79) ADAM17MMP1MMP2MMP9MMP3
SCHEMBL21823203 0.77 ADAM17 (0.81) ADAM17MMP1MMP2MMP9MMP3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1027332-A1 NOVEL LACTAM METALLOPROTEASE INHIBITORS Du Pont Pharmaceuticals Company (US) 2000-08-16 EP disclosed
WO-1999018074-A1 NOVEL LACTAM METALLOPROTEASE INHIBITORS Britol-Myers Squibb Pharma Company (US) 1999-04-15 WO disclosed