SCHEMBL2680253

SCHEMBL2680253

CC(C)C[C@H](CC(=O)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N(C)Cc1ccccc1

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 12/20 0.72
MMP8 P22894 10/20 0.72
MMP9 P14780 9/20 0.72
MMP1 P03956 8/20 0.72
TACR1 P25103 2/20 0.70
ECE1 P42892 1/20 0.61
ADAM10 O14672 1/20 0.60
ADAM12 O43184 1/20 0.60
ADAMTS4 O75173 1/20 0.60
MMP3 P08254 1/20 0.60
MMP7 P09237 1/20 0.60
MMP12 P39900 1/20 0.60
MMP13 P45452 1/20 0.60
MMP14 P50281 1/20 0.60
MMP15 P51511 1/20 0.60
MMP16 P51512 1/20 0.60
ADAM17 P78536 1/20 0.60
ADAM9 Q13443 1/20 0.60
MMP26 Q9NRE1 1/20 0.60
MMP17 Q9ULZ9 1/20 0.60

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
SCHEMBL6438893 0.90 TACR1 (0.69) MMP2MMP8MMP9MMP1TACR1
SCHEMBL7193888 0.90 TACR1 (0.69) MMP2MMP8MMP9MMP1TACR1
SCHEMBL4795667 0.86 MMP2 (0.85) MMP2MMP8MMP9MMP1ECE1
SCHEMBL6575025 0.86 MMP2 (0.85) MMP2MMP8MMP9MMP1ECE1
SCHEMBL7412775 0.85 MMP2 (0.84) MMP2MMP8MMP9MMP1ECE1
SCHEMBL6577793 0.84 MMP2 (1.00) MMP2MMP8MMP9MMP1ECE1
SCHEMBL8200364 0.84 TACR1 (0.86) MMP8MMP9TACR1MMP14CCKBR
SCHEMBL8200367 0.84 TACR1 (0.86) MMP8MMP9TACR1MMP14CCKBR
SCHEMBL7457278 0.83 MMP1 (0.78) MMP2MMP8MMP9MMP1MMP7
SCHEMBL6575485 0.82 MMP1 (0.82) MMP2MMP8MMP9MMP1ECE1

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 54 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2012112945-A1 USE OF MATRIX METALLOPROTEINASE INHIBITORS TO TREAT TUBERCULOSIS THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2012-08-23 WO claimed
EP-3964242-B1 SURGICAL STAPLER WITH END EFFECTOR COATING CILAG GMBH INT (CH) 2026-02-18 EP disclosed
US-11666335-B2 Surgical stapler with end effector coating CILAG GMBH INTERNATIONAL (CH) 2023-06-06 US disclosed
CN-111032104-B Surgical stapler with end effector coating 爱惜康有限责任公司 2022-08-12 CN disclosed
CN-110740763-B Surgical fastener device for preventing degradation of ECM 爱惜康有限责任公司 2022-08-09 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-3964242-A1 SURGICAL STAPLER WITH END EFFECTOR COATING Cilag GmbH International (CH) 2022-03-09 EP disclosed
EP-3415179-B1 SURGICAL FASTENER DEVICE FOR THE PREVENTION OF ECM DEGRADATION ETHICON LLC (PR) 2021-12-01 EP disclosed
EP-3415176-B1 SURGICAL STAPLER WITH END EFFECTOR COATING CILAG GMBH INT (CH) 2021-09-29 EP disclosed
US-20040248813-A1 Compounds and methods for the modulation of cd154 CBR INSTITUTE FOR BIOMEDICAL RESEARCH, INC. 2004-12-09 US disclosed
WO-2004105837-A2 COMPOUNDS AND METHODS FOR IMPROVING PLATELET RECOVERY AND FUNCTION CENTER FOR BLOOD RESEARCH, INC. (US) 2004-12-09 WO disclosed
US-20040235950-A1 Compositions and methods for use against acne-induced inflammation and dermal matrix-degrading enzymes REGENTS OF THE UNIVERSITY OF MICHIGAN, THE 2004-11-25 US disclosed
US-20040072750-A1 Compounds and methods for the modulation of CD154 MILLENNIUM PHARMACEUTICALS, INC. 2004-04-15 US disclosed
EP-1399466-A2 COMPOUNDS AND METHODS FOR THE MODULATION OF CD154 MILLENNIUM PHARMACEUTICALS, INC. (US) 2004-03-24 EP disclosed
US-20040048803-A1 Compounds and methods for the modulation of CD154 PHILLIPS DAVID (US) 2004-03-11 US disclosed
EP-1284721-A2 COMPOSITIONS AND METHODS FOR USE AGAINST ACNE-INDUCED INFLAMMATION AND DERMAL MATRIX-DEGRADING ENZYMES THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2003-02-26 EP disclosed
WO-2002089730-A2 COMPOUNDS AND METHODS FOR THE MODULATION OF CD154 THE CENTER FOR BLOOD RESEARCH, INC. (US) 2002-11-14 WO disclosed
US-20020165166-A1 Compounds and methods for the modulation of CD154 CBR INSTITUTE FOR BIOMEDICAL RESEARCH, INC. 2002-11-07 US disclosed
WO-2001089502-A2 COMPOSITIONS AND METHODS FOR USE AGAINST ACNE-INDUCED INFLAMMATION AND DERMAL MATRIX-DEGRADING ENZYMES THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2001-11-29 WO disclosed