SCHEMBL4082323

SCHEMBL4082323

COc1cccc(CN([C@H](CC(C)C)C(=O)NO)S(=O)(=O)c2ccc(OCCCCl)cc2)c1

nearest known ligand 0.51

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 8/20 0.51
MMP9 P14780 8/20 0.51
MMP13 P45452 6/20 0.51
MMP8 P22894 4/20 0.51
BMP1 P13497 11/20 0.49
MMP3 P08254 2/20 0.47

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
SCHEMBL4082328 1.00 MMP2 (0.51) MMP2MMP9MMP13MMP8BMP1
SCHEMBL4071644 0.92 MMP2 (0.56) MMP2MMP9MMP13MMP8BMP1
SCHEMBL4071641 0.92 MMP2 (0.56) MMP2MMP9MMP13MMP8BMP1
SCHEMBL2854359 0.92 MMP2 (0.56) MMP2MMP9MMP13MMP8BMP1
SCHEMBL2854368 0.92 MMP2 (0.56) MMP2MMP9MMP13MMP8BMP1
SCHEMBL2860368 0.90 BMP1 (0.58) MMP2MMP9MMP13MMP8BMP1
SCHEMBL2860365 0.90 BMP1 (0.58) MMP2MMP9MMP13MMP8BMP1
SCHEMBL2859433 0.90 MMP2 (0.53) MMP2MMP9MMP13MMP8BMP1
SCHEMBL2859432 0.90 MMP2 (0.53) MMP2MMP9MMP13MMP8BMP1
SCHEMBL2860130 0.89 BMP1 (0.62) MMP2MMP9MMP13MMP8BMP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2085379-A1 Arylsulfonamido-substituted hydroxamic acid derivatives Novartis AG (CH) 2009-08-05 EP claimed
US-7138432-B1 Arylsulfonamido-substituted hydroxamic acid derivatives NOVARTIS AG (CH) 2006-11-21 US claimed
EP-1202961-A1 ARYLSULFONAMIDO-SUBSTITUTED HYDROXAMIC ACID DERIVATIVES Novartis AG (CH) 2002-05-08 EP claimed
WO-2001010827-A1 ARYLSULFONAMIDO-SUBSTITUTED HYDROXAMIC ACID DERIVATIVES NOVARTIS AG (CH) 2001-02-15 WO claimed
EP-2085379-A1 Arylsulfonamido-substituted hydroxamic acid derivatives Novartis AG (CH) 2009-08-05 EP disclosed