SCHEMBL4845965

SCHEMBL4845965

CC(C)C[C@H](CC(=O)NO)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O

nearest known ligand 0.84

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 11/20 0.84
MMP9 P14780 11/20 0.84
MMP8 P22894 11/20 0.84
MMP1 P03956 6/20 0.84
ADAM10 O14672 1/20 0.84
ADAM12 O43184 1/20 0.84
ADAMTS4 O75173 1/20 0.84
MMP3 P08254 1/20 0.84
MMP7 P09237 1/20 0.84
MMP12 P39900 1/20 0.84
MMP13 P45452 1/20 0.84
MMP14 P50281 1/20 0.84
MMP15 P51511 1/20 0.84
MMP16 P51512 1/20 0.84
ADAM17 P78536 1/20 0.84
ADAM9 Q13443 1/20 0.84
MMP26 Q9NRE1 1/20 0.84
MMP17 Q9ULZ9 1/20 0.84
ADAMTS5 Q9UNA0 1/20 0.84
LTA4H P09960 1/20 0.78

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
SCHEMBL5060570 0.91 MMP2 (0.83) MMP2MMP9MMP8MMP1ADAM10
Ilomastat SCHEMBL13575799 0.91 MMP2 (1.00) MMP2MMP9MMP8MMP1ADAM10
Ilomastat SCHEMBL8190117 0.91 MMP2 (1.00) MMP2MMP9MMP8MMP1ADAM10
Ilomastat SCHEMBL7870487 0.91 MMP2 (1.00) MMP2MMP9MMP8MMP1ADAM10
Ilomastat SCHEMBL29412562 0.91 MMP2 (1.00) MMP2MMP9MMP8MMP1ADAM10
Ilomastat SCHEMBL4394885 0.91 MMP2 (1.00) MMP2MMP9MMP8MMP1ADAM10
Ilomastat SCHEMBL4293696 0.91 MMP2 (1.00) MMP2MMP9MMP8MMP1ADAM10
Ilomastat SCHEMBL35303 0.91 MMP2 (1.00) MMP2MMP9MMP8MMP1ADAM10
Ilomastat SCHEMBL6691646 0.91 MMP2 (1.00) MMP2MMP9MMP8MMP1ADAM10
SCHEMBL4795667 0.91 MMP2 (0.85) MMP2MMP9MMP8MMP1ADAM10

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
CN-111032104-B Surgical stapler with end effector coating 爱惜康有限责任公司 2022-08-12 CN disclosed
CN-110769866-B Surgical stapler with controlled healing 爱惜康有限责任公司 2022-07-29 CN disclosed
CN-110740764-B Surgical fasteners with broad spectrum MMP inhibitors 爱惜康有限责任公司 2022-05-27 CN disclosed
EP-1986657-A2 METHOD OF TREATING A SUBJECT SUFFERING FROM DEGENERATIVE DISC DISEASE USING A MATRIX METALLOPROTEASE INHIBITOR Discogen, LLC (US) 2008-11-05 EP disclosed
WO-2007098099-A2 METHOD OF TREATING A SUBJECT SUFFERING FROM DEGENERATIVE DISC DISEASE USING A MATRIX METALLOPROTEASE INHIBITOR DISCOGEN, LLC (US) 2007-08-30 WO disclosed