SCHEMBL7352853

SCHEMBL7352853

Cc1ccc(Oc2ccc(C3(C)CCN(C(C)C(N)=O)C3=O)cc2)cc1

nearest known ligand 0.62

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ADAM17 P78536 9/20 0.62
MMP1 P03956 8/20 0.62
MMP2 P08253 11/20 0.57
MMP9 P14780 11/20 0.57
MMP3 P08254 1/20 0.44
MMP7 P09237 1/20 0.44
MMP8 P22894 1/20 0.44
MMP13 P45452 1/20 0.44
MMP14 P50281 1/20 0.44
MMP15 P51511 1/20 0.44
MMP16 P51512 1/20 0.44
ADAM33 Q9BZ11 1/20 0.44
CCR2 P41597 1/20 0.36
HSD11B1 P28845 1/20 0.36

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
SCHEMBL7359520 0.91 ADAM17 (0.76) ADAM17MMP1MMP2MMP9MMP3
SCHEMBL7353080 0.86 MMP2 (0.61) ADAM17MMP1MMP2MMP9MMP3
SCHEMBL6628726 0.86 ADAM17 (0.83) ADAM17MMP1MMP2MMP9MMP3
SCHEMBL7351232 0.84 MMP2 (0.55) ADAM17MMP1MMP2MMP9MMP3
SCHEMBL6628307 0.81 MMP2 (0.60) ADAM17MMP1MMP2MMP9MMP3
SCHEMBL7253215 0.80 MMP2 (0.61) ADAM17MMP1MMP2MMP9MMP3
SCHEMBL7355036 0.78 MMP2 (0.74) ADAM17MMP1MMP2MMP9MMP3
SCHEMBL7354605 0.78 MMP2 (0.59) ADAM17MMP1MMP2MMP9
SCHEMBL6628207 0.78 MMP2 (0.79) ADAM17MMP1MMP2MMP9MMP3
SCHEMBL7360865 0.77 ADAM17 (0.79) 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