SCHEMBL6625992

SCHEMBL6625992

Cc1cc(COc2ccc(C3(C)CCN(C(C)C(=O)NO)C3=O)cc2)cc(NC(=O)CNC(=O)[C@H](NC(=O)O)C(C)(C)C)c1

nearest known ligand 0.69

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 13/20 0.69
MMP9 P14780 12/20 0.69
MMP1 P03956 9/20 0.69
ADAM17 P78536 12/20 0.59
MMP3 P08254 3/20 0.52
MMP7 P09237 2/20 0.52
MMP8 P22894 2/20 0.52
MMP13 P45452 2/20 0.52
MMP14 P50281 2/20 0.52
MMP15 P51511 1/20 0.52
MMP16 P51512 1/20 0.52
ADAM33 Q9BZ11 1/20 0.52
ADAM10 O14672 1/20 0.37

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
SCHEMBL6628527 0.93 MMP2 (0.75) MMP2MMP9MMP1ADAM17MMP3
SCHEMBL6630955 0.91 MMP2 (0.78) MMP2MMP9MMP1ADAM17MMP3
SCHEMBL6626865 0.89 MMP2 (0.76) MMP2MMP9MMP1ADAM17MMP3
SCHEMBL6631455 0.86 MMP2 (0.67) MMP2MMP9MMP1ADAM17MMP3
SCHEMBL27520345 0.86 MMP2 (0.67) MMP2MMP9MMP1ADAM17MMP3
SCHEMBL6630353 0.84 MMP2 (0.71) MMP2MMP9MMP1ADAM17MMP3
SCHEMBL13274077 0.82 MMP2 (1.00) MMP2MMP9MMP1ADAM17MMP3
SCHEMBL6838778 0.82 MMP2 (1.00) MMP2MMP9MMP1ADAM17MMP3
SCHEMBL6628081 0.82 MMP2 (0.52) MMP2MMP9MMP1ADAM17MMP3
SCHEMBL7353396 0.81 MMP2 (0.72) MMP2MMP9MMP1ADAM17MMP3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1027332-B1 NOVEL LACTAM METALLOPROTEASE INHIBITORS BRISTOL MYERS SQUIBB PHARMA CO (US) 2004-05-26 EP claimed
EP-1385847-A2 PYRAZOLO[1,5-A]PYRIDINE DERIVATIVES SmithKline Beecham Corporation (US) 2004-02-04 EP disclosed
US-6610731-B2 Antiinflammatory BRISTOL-MYERS SQUIBB COMPANY 2003-08-26 US disclosed
WO-2002088124-A2 PYRAZOLO'1,5-A!PYRIDINE DERIVATIVES SMITHKLINE BEECHAM CORPORATION (US) 2002-11-07 WO disclosed