SCHEMBL7368214

SCHEMBL7368214

CC(C)[C@H](NC(=O)[C@@H](N)Cc1ccccc1)C(=O)N(C(=O)c1ccc(OCc2ccccc2)cc1)c1n[nH]c(=S)s1

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LNPEP Q9UIQ6 5/20 0.41
PSMB1 P20618 1/20 0.40
PSMB9 P28065 1/20 0.40
PSMB5 P28074 1/20 0.40
PSMB10 P40306 1/20 0.40
PSMB2 P49721 1/20 0.40
ERAP2 Q6P179 2/20 0.39
LTA4H P09960 2/20 0.38
MMP3 P08254 4/20 0.38
HRAS P01112 2/20 0.38
MMP1 P03956 1/20 0.37
MMP2 P08253 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
SCHEMBL7358533 0.92 MMP3 (0.39) LNPEPERAP2MMP3MMP1MMP2
SCHEMBL7355861 0.90 PSMB1 (0.41) LNPEPPSMB1PSMB9PSMB5PSMB10
SCHEMBL7356789 0.90 MMP3 (0.43) MMP3MMP1MMP2
SCHEMBL7361335 0.86 MMP3 (0.42) LNPEPERAP2MMP3MMP1MMP2
SCHEMBL7394273 0.84 ITGB3 (0.44) LNPEPERAP2HRAS
SCHEMBL7423322 0.81 ERAP2 (0.40) LNPEPERAP2MMP3MMP1MMP2
SCHEMBL7396119 0.81 MMP3 (0.44) MMP3MMP1MMP2
SCHEMBL7360307 0.80 LIMK2 (0.40) MMP1MMP2
SCHEMBL7358575 0.80 PTPN1 (0.46) LNPEPPSMB1PSMB9PSMB5PSMB10
SCHEMBL7364939 0.80 ERAP2 (0.40) LNPEPERAP2MMP3MMP1MMP2

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
WO-1998025949-A1 SUBSTITUTED 5-AMINO-1,3,4-THIADIAZOLE-2-THIONES PROSCRIPT, INC. (US) 1998-06-18 WO disclosed
EP-0845002-A2 AMINO ACID AMIDES OF 5-AMINO-1,3,4-THIADIAZONES AND THEIR USE AS INHIBITORS FOR MATRIX METALLOPROTEINASES PROSCRIPT, INC. (US) 1998-06-03 EP disclosed
US-5677282-A ENZYME INHIBITOR; OSTEOARTHRITIS AND RHEUMATIC DISORDERS PROSCRIPT, INC. (US) 1997-10-14 US disclosed
WO-1996040745-A2 AMINO ACID AMIDES OF 5-AMINO-1,3,4-THIADIAZONES AND THEIR USE AS INHIBITORS FOR MATRIX METALLOPROTEINASES PROSCRIPT, INC. (US) 1996-12-19 WO disclosed