SCHEMBL6554500

SCHEMBL6554500

CC(C)C[C@H](NC(=O)[C@@H](S)CCN1C(=O)N(C)C(C)(C)C1=O)C(=O)N(C)[C@H](C(N)=O)C(C)(C)C

nearest known ligand 0.64

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 5/20 0.64
MMP9 P14780 5/20 0.64
MMP1 P03956 4/20 0.64
MMP3 P08254 4/20 0.64
MMP13 P45452 4/20 0.64
MMP7 P09237 1/20 0.64
MMP14 P50281 1/20 0.64
MMP8 P22894 2/20 0.40
CTSL P07711 1/20 0.31
MME P08473 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
SCHEMBL7629106 0.82 MMP1 (0.61) MMP2MMP9MMP1MMP3MMP13
SCHEMBL6763693 0.82 MMP1 (0.61) MMP2MMP9MMP1MMP3MMP13
SCHEMBL6547584 0.80 MMP9 (0.70) MMP2MMP9MMP1MMP3MMP13
SCHEMBL4787630 0.80 MMP9 (0.70) MMP2MMP9MMP1MMP3MMP13
SCHEMBL6554608 0.79 MMP9 (0.84) MMP2MMP9MMP1MMP3MMP13
SCHEMBL7254495 0.79 MMP9 (0.84) MMP2MMP9MMP1MMP3MMP13
Rebimastat SCHEMBL12946005 0.78 MMP1 (1.00) MMP2MMP9MMP1MMP3MMP13
Rebimastat SCHEMBL645121 0.78 MMP1 (1.00) MMP2MMP9MMP1MMP3MMP13
Rebimastat SCHEMBL12247619 0.78 MMP1 (1.00) MMP2MMP9MMP1MMP3MMP13
Rebimastat SCHEMBL4826862 0.78 MMP1 (1.00) MMP2MMP9MMP1MMP3MMP13

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160045463-A1 USE OF METALLOPROTEASE INHIBITORS IN THE TREATMENT OF POLYCYSTIC LIVER DISEASES UNIVERSIDAD DE SALAMANCA (ES) 2016-02-18 US disclosed
US-20160045463-A1 USE OF METALLOPROTEASE INHIBITORS IN THE TREATMENT OF POLYCYSTIC LIVER DISEASES UNIVERSIDAD DE SALAMANCA (ES) 2016-02-18 US disclosed
US-20040208924-A1 Pharmaceutical tablet having a high api content BRISTOL-MYERS SQUIBB COMPANY 2004-10-21 US disclosed
US-20040175419-A1 Control of compactibility through cystallization BRISTOL-MYERS SQUIBB COMPANY 2004-09-09 US disclosed
EP-1390011-A2 CONTROL OF COMPACTABILITY THROUGH CRYSTALLIZATION Bristol-Myers Squibb Company (US) 2004-02-25 EP disclosed
EP-1390018-A1 A PHARMACEUTICAL TABLET HAVING A HIGH API CONTENT Bristol-Myers Squibb Company (US) 2004-02-25 EP disclosed
WO-2002088664-A2 CONTROL OF COMPACTABILITY THROUGH CRYSTALLIZATION BRISTOL-MYERS SQUIBB COMPANY (US) 2002-11-07 WO disclosed
WO-2002087548-A1 A PHARMACEUTICAL TABLET HAVING A HIGH API CONTENT BRISTOL-MYERS SQUIBB COMPANY (US) 2002-11-07 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 (3 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-20160045463-A1 USE OF METALLOPROTEASE INHIBITORS IN THE TREATMENT OF POLYCYSTIC LIVER DISEASES PKD1, MMP3, PKD2 MMP2 37/4885MMP9 17/4885MMP1 23/4885
US-20040175419-A1 Control of compactibility through cystallization PKD1, PKD2, CALU MMP2 1871/4885MMP9 1395/4885MMP1 564/4885
US-20040208924-A1 Pharmaceutical tablet having a high api content TREH, SI, CYP3A5 MMP2 3385/4885MMP9 2183/4885MMP1 3708/4885

“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.