SCHEMBL7607652

SCHEMBL7607652

CC(C)(C)OC(=O)CC(C(=O)NC(C(=O)Nc1ccncc1)C(C)(C)C)c1ccsc1

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 10/20 0.46
MMP3 P08254 6/20 0.46
LMNA P02545 2/20 0.38
HTT P42858 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
CYP17A1 P05093 1/20 0.35
FFAR2 O15552 1/20 0.35
HSPA5 P11021 1/20 0.35
TDP1 Q9NUW8 1/20 0.34

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
SCHEMBL7607661 1.00 MMP2 (0.46) MMP2MMP3LMNAHTTSMN1; SMN2
SCHEMBL7694340 0.89 MMP2 (0.55) MMP2MMP3LMNAHTTSMN1; SMN2
SCHEMBL7604680 0.89 MMP2 (0.55) MMP2MMP3LMNAHTTSMN1; SMN2
SCHEMBL7604668 0.89 MMP2 (0.55) MMP2MMP3LMNAHTTSMN1; SMN2
SCHEMBL7606100 0.75 MMP1 (0.53) MMP2MMP3
SCHEMBL7606096 0.75 MMP1 (0.53) MMP2MMP3
SCHEMBL7403819 0.75 MMP2 (0.50) MMP2MMP3LMNACYP17A1FFAR2
SCHEMBL7607675 0.74 LMNA (0.38) MMP2MMP3LMNAHTTSMN1; SMN2
SCHEMBL7409386 0.74 MMP3 (0.43) MMP2MMP3SMN1; SMN2
SCHEMBL7409388 0.74 MMP3 (0.43) MMP2MMP3SMN1; SMN2

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
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

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 MMP2 2/4885MMP3 3/4885LMNA 1232/4885

“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.