SCHEMBL4968073

SCHEMBL4968073

CC(C)C[C@H](NC(=O)[C@H](CC(C)C)N(Cc1ccccc1)C(=O)O)C(=O)O

nearest known ligand 0.65

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MME P08473 3/20 0.59
LTA4H P09960 1/20 0.50
MMP1 P03956 3/20 0.49
MMP3 P08254 3/20 0.49
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
MMP2 P08253 2/20 0.47
MMP7 P09237 2/20 0.47
MMP9 P14780 2/20 0.47
MMP8 P22894 1/20 0.47
MMP12 P39900 1/20 0.47
MMP13 P45452 1/20 0.47
CTSL P07711 1/20 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
SCHEMBL2246262 0.88 MME (0.47) MMELTA4HMMP1MMP3MEN1
SCHEMBL20741008 0.85 CTSK (0.48) MMEMMP1MMP3MMP2MMP7
SCHEMBL6465336 0.85 PSMB1 (0.49) MMEMMP1MMP3MMP9MMP8
SCHEMBL20741006 0.85 CTSK (0.48) MMEMMP1MMP3MMP2MMP7
SCHEMBL30450002 0.85 PSMB1 (0.49) MMEMMP1MMP3MMP9MMP8
SCHEMBL25259821 0.85 PSMB1 (0.49) MMEMMP1MMP3MMP9MMP8
SCHEMBL5366694 0.85 CTSL (0.44) MMELTA4HMMP1MMP3MEN1
SCHEMBL20603581 0.82 PSMB5 (0.50) MMEMMP1MMP3MMP2MMP7
SCHEMBL5712419 0.82 CAPN1 (0.54) MMP1MMP3MEN1KMT2AMMP2
Carbamic Acid SCHEMBL30450803 0.82 CAPN1 (0.48) MMEMMP1MMP3CTSL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0912601-B2 SUPPRESSION OF IMMUNE RESPONSE VIA INHIBITION OF CATHEPSIN S MASSACHUSETTS INST TECHNOLOGY (US) 2008-11-05 EP disclosed
US-7427591-B2 Suppression of immune response via inhibition of cathepsin S MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2008-09-23 US disclosed
US-7285525-B2 Suppression of immune response via inhibition of cathepsin S MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2007-10-23 US disclosed
US-20050095248-A1 Suppression of immune response via inhibition of cathepsin S MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2005-05-05 US disclosed
US-20050080010-A1 Suppression of immune response via inhibition of cathepsin S NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2005-04-14 US disclosed
EP-1400530-A1 Suppression of immune response via inhibition of cathepsin S MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2004-03-24 EP disclosed
EP-0912601-B1 SUPPRESSION OF IMMUNE RESPONSE VIA INHIBITION OF CATHEPSIN S MASSACHUSETTS INST TECHNOLOGY (US) 2003-11-26 EP disclosed
US-20030166534-A1 Suppression of immune response via inhibition of cathepsin S MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2003-09-04 US disclosed
US-6608030-B1 Suppression of immune response via inhibition of cathepsin S BRIGHAM & WOMEN'S HOSPITAL, INC. 2003-08-19 US disclosed
EP-0912601-A1 SUPPRESSION OF IMMUNE RESPONSE VIA INHIBITION OF CATHEPSIN S MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 1999-05-06 EP disclosed
WO-1997040066-A1 SUPPRESSION OF IMMUNE RESPONSE VIA INHIBITION OF CATHEPSIN S MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 1997-10-30 WO disclosed