SCHEMBL6260100

SCHEMBL6260100

C#CCN1CC(NC(=O)c2ccc(Cc3cc(C)nc4ccccc34)cc2)C(C(=O)NO)C1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ADAM17 P78536 13/20 1.00
MMP2 P08253 3/20 0.81
MMP3 P08254 3/20 0.81
MMP7 P09237 3/20 0.81
MMP12 P39900 2/20 0.81
MMP10 P09238 2/20 0.81
MMP9 P14780 1/20 0.81
MMP8 P22894 1/20 0.81
MMP13 P45452 1/20 0.81
MMP14 P50281 1/20 0.81

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
SCHEMBL6789205 1.00 ADAM17 (1.00) ADAM17MMP2MMP3MMP7MMP12
SCHEMBL6260124 1.00 ADAM17 (1.00) ADAM17MMP2MMP3MMP7MMP12
SCHEMBL6260106 1.00 ADAM17 (1.00) ADAM17MMP2MMP3MMP7MMP12
SCHEMBL6791287 0.93 ADAM17 (0.86) ADAM17MMP2MMP3MMP7MMP12
SCHEMBL6791356 0.91 ADAM17 (1.00) ADAM17MMP2MMP3MMP7MMP12
SCHEMBL6790054 0.90 ADAM17 (0.82) ADAM17MMP2MMP3MMP7MMP12
SCHEMBL6791369 0.90 ADAM17 (0.82) ADAM17MMP2MMP3MMP7MMP12
SCHEMBL5898489 0.90 MMP2 (1.00) ADAM17MMP2MMP3MMP7MMP12
SCHEMBL7430026 0.88 ADAM17 (0.86) ADAM17MMP2MMP3MMP7MMP12
SCHEMBL6790903 0.88 ADAM17 (0.79) ADAM17MMP2MMP3MMP7MMP12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1427408-A4 CYCLIC HYDROXAMIC ACIDS AS INHIBITORS OF MATRIX METALLOPROTEINASES AND/OR TNF-$g(a) CONVERTING ENZYME (TACE) BRISTOL MYERS SQUIBB CO (US) 2005-10-26 EP disclosed
EP-1427408-A2 CYCLIC HYDROXAMIC ACIDS AS INHIBITORS OF MATRIX METALLOPROTEINASES AND/OR TNF-$g(a) CONVERTING ENZYME (TACE) BRISTOL-MYERS SQUIBB COMPANY (US) 2004-06-16 EP disclosed
WO-2003024899-A2 CYCLIC HYDROXAMIC ACIDS AS INHIBITORS OF MATRIX METALLOPROTEINASES AND/OR TNF-α CONVERTING ENZYME (TACE) BRISTOL-MYERS SQUIBB COMPANY (US) 2003-03-27 WO disclosed