SCHEMBL7460139

SCHEMBL7460139

CC(C)(C)OC(=O)CC(C(=O)NN1C(Cc2ccccc2)COC1(C)C)c1ccn(-c2ccc(-c3ccccc3)cc2)c1

nearest known ligand 0.32

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CPB2 Q96IY4 2/20 0.32
CTSS P25774 3/20 0.31
CTSK P43235 3/20 0.31
NR1H2 P55055 2/20 0.31
NR1H3 Q13133 2/20 0.31
CA2 P00918 1/20 0.31
CA9 Q16790 1/20 0.31
CTSB P07858 1/20 0.30
CACNA1G O43497 2/20 0.30
KLK7 P49862 1/20 0.30
KLK5 Q9Y337 1/20 0.30

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
SCHEMBL7460143 1.00 CPB2 (0.32) CPB2CTSSCTSKNR1H2NR1H3
SCHEMBL7405602 0.91 CTSL (0.31) CTSSCTSKCTSB
SCHEMBL7409470 0.88 NR1H2 (0.32) CPB2NR1H2NR1H3CACNA1GKLK7
SCHEMBL7606288 0.88 NR1H2 (0.32) CPB2NR1H2NR1H3CACNA1GKLK7
SCHEMBL7605407 0.88 NR1H2 (0.32) CPB2NR1H2NR1H3CACNA1GKLK7
SCHEMBL7409927 0.85 CTSS (0.32) CTSSCTSKNR1H2NR1H3CA2
SCHEMBL7409925 0.85 CTSS (0.32) CTSSCTSKNR1H2NR1H3CA2
SCHEMBL7407015 0.84 SMN1; SMN2 (0.33)
SCHEMBL7408691 0.84 CTSS (0.33) CTSSCTSKNR1H2NR1H3CA2
SCHEMBL7408693 0.84 CTSS (0.33) CTSSCTSKNR1H2NR1H3CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6495699-B2 ANTIARTHRITIC AGENTS; OSTEOPOROSIS AGOURON PHARMACEUTICALS INC. 2002-12-17 US disclosed
US-20020019429-A1 Metalloproteinase inhibitors, pharmaceutical compositions containing them, and their use BENDER STEVEN L (US) 2002-02-14 US disclosed
US-6306892-B1 ENZYME INHIBITORS HETEROCYCLIC AMIDES AGOURON PHARMACEUTICALS, INC. 2001-10-23 US disclosed
US-6174915-B1 FOR TREATING MAMMALIAN DISEASE CONDITION MEDIATED BY METALLOPROTEINASE ACTIVITY AGOURON PHARMACEUTICALS, INC. 2001-01-16 US disclosed
US-6008243-A AN ENZYME INHIBITOR FOR PREVENTING THE DEGRADATION AND REMODELING OF CONNECTIVE TISSUES AGOURON PHARMACEUTICALS, INC. (US) 1999-12-28 US disclosed
EP-0937042-A1 HETEROARYL SUCCINAMIDES AND THEIR USE AS METALLOPROTEINASE INHIBITORS AGOURON PHARMACEUTICALS, INC. (US) 1999-08-25 EP disclosed
WO-1998017643-A1 HETEROARYL SUCCINAMIDES AND THEIR USE AS METALLOPROTEINASE INHIBITORS AGOURON PHARMACEUTICALS, INC. (US) 1998-04-30 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20020019429-A1 Metalloproteinase inhibitors, pharmaceutical compositions containing them, and their use MMP9, MMP2, MMP3 CPB2 96/4885CTSS 54/4885CTSK 64/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.