SCHEMBL7205260

SCHEMBL7205260

CCc1ccc(NC(=O)[C@H]2O[C@@H]2C(=O)N[C@@H](Cc2ccccc2)C(=O)N(C)C)cc1

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MMP9 P14780 3/20 0.50
MMP8 P22894 3/20 0.50
MMP14 P50281 1/20 0.50
CAPN1 P07384 2/20 0.45
KMT2A Q03164 2/20 0.44
PYGL P06737 3/20 0.43
F13A1 P00488 2/20 0.42
TGM2 P21980 2/20 0.42
MMP3 P08254 1/20 0.42
ITGA4 P13612 2/20 0.42
TACR1 P25103 1/20 0.42
MEN1 O00255 1/20 0.41
CRHBP P24387 1/20 0.40
CRHR2 Q13324 1/20 0.40

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
SCHEMBL7205257 1.00 MMP9 (0.50) MMP9MMP8MMP14CAPN1KMT2A
SCHEMBL7205316 0.92 MMP9 (0.55) MMP9MMP8MMP14CAPN1KMT2A
SCHEMBL7205323 0.92 MMP9 (0.55) MMP9MMP8MMP14CAPN1KMT2A
Hydrochloric Acid SCHEMBL7208321 0.90 MMP9 (0.48) MMP9MMP8MMP14CAPN1KMT2A
Hydrochloric Acid SCHEMBL7208324 0.90 MMP9 (0.48) MMP9MMP8MMP14CAPN1KMT2A
SCHEMBL7202948 0.89 MMP9 (0.50) MMP9MMP8MMP14CAPN1KMT2A
SCHEMBL7202940 0.89 MMP9 (0.50) MMP9MMP8MMP14CAPN1KMT2A
SCHEMBL7207193 0.88 F13A1 (0.56) MMP9MMP8MMP14CAPN1F13A1
SCHEMBL14513403 0.88 MMP9 (0.63) MMP9MMP8MMP14CAPN1KMT2A
SCHEMBL7203445 0.88 MMP9 (0.48) MMP9MMP8MMP14CAPN1KMT2A

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-20070293937-A1 Endoluminal medical device for local delivery of cathepsin inhibitors, method of making and treating MED INSTITUTE, INC. 2007-12-20 US disclosed
US-20070293937-A1 Endoluminal medical device for local delivery of cathepsin inhibitors, method of making and treating MED INSTITUTE, INC. 2007-12-20 US disclosed
EP-0921122-B1 EPOXYSUCCINAMIDE DERIVATIVES OR SALTS THEREOF TAIHO PHARMACEUTICAL CO LTD (JP) 2003-05-21 EP disclosed
US-6110967-A USEFUL AS AGENTS FOR PREVENTING AND TREATING METABOLIC OSTEOPATHY SUCH AS OSTEOPOROSIS, HYPERCALCEMIA AND BONE METASTASIS OF CANCER BECAUSE THEY SPECIFICALLY INHIBITS CATHEPSIN L AND ITS FAMILY ENZYMES TO INHIBIT BONE RESORPTION TAIHO PHARMACEUTICALS CO., LTD. (JP) 2000-08-29 US disclosed
EP-0921122-A1 NOVEL EPOXYSUCCINAMIDE DERIVATIVES OR SALTS THEREOF TAIHO PHARMACEUTICAL COMPANY, LIMITED (JP) 1999-06-09 EP 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-20070293937-A1 Endoluminal medical device for local delivery of cathepsin inhibitors, method of making and treating CTSS, CTSD, CTSV MMP9 91/4885MMP8 95/4885MMP14 128/4885

“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.