SCHEMBL7053487

SCHEMBL7053487

CCCN(C)S(=O)(=O)N1CCN(S(=O)(=O)c2ccc(-c3ccc(C(F)(F)F)cc3)s2)[C@@H](C(=O)NO)C1

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 6/20 0.41
MMP13 P45452 6/20 0.41
MMP3 P08254 7/20 0.38
MMP7 P09237 5/20 0.38
MMP9 P14780 4/20 0.38
MMP8 P22894 4/20 0.37
MCHR1 Q99705 4/20 0.36
GAA P10253 1/20 0.36

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
SCHEMBL7054554 0.90 LMNA (0.43) MMP1MMP13MMP3MMP7MMP9
SCHEMBL7052925 0.89 GAA (0.44) MMP1MMP13MMP3MMP7MMP9
SCHEMBL7059693 0.86 MMP13 (0.51) MMP1MMP13MMP3MMP7MMP9
SCHEMBL7054228 0.85 MMP1 (0.43) MMP1MMP13MMP3MMP7MMP9
SCHEMBL7056052 0.85 MMP13 (0.38) MMP1MMP13MCHR1GAA
SCHEMBL7053484 0.83 MMP13 (0.46) MMP1MMP13MMP3MMP7MMP9
SCHEMBL7352469 0.83 MMP3 (0.41) MMP1MMP13MMP3MMP7MMP9
SCHEMBL7052651 0.82 MMP1 (0.40) MMP1MMP13MMP3MMP7MMP9
SCHEMBL7053684 0.81 MMP3 (0.43) MMP1MMP13MMP3MMP7MMP9
SCHEMBL7054430 0.80 MMP1 (0.42) MMP1MMP13MMP3MMP7MMP9

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-20030060473-A1 Piperazine compounds as inhibitors of MMP or TNF FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2003-03-27 US disclosed
US-6489324-B2 TREATING STROKE, ARHTRITIS, CANCER, TISSUE ULCERATION, DECUBITIS ULCER, RESTENOSIS, PERIODONTAL DISEASE, EPIDERMOLYSIS BULLOSA, SCLERITIS, PSORIASIS, AIDS, SEPSIS, AND SEPTIC SHOCK. FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-12-03 US disclosed
US-6333324-B1 FOR THERAPY AND PROPHYLAXIS OF MATRIX METALLOPROTEINASES (MMP) OR TUMOR NECROSIS FACTOR .ALPHA. (TNF.ALPHA.), MEDIATED DISEASES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2001-12-25 US disclosed
EP-0948489-A1 PIPERAZINE COMPOUNDS AS INHIBITORS OF MMP OR TNF FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1999-10-13 EP disclosed
WO-1998027069-A1 PIPERAZINE COMPOUNDS AS INHIBITORS OF MMP OR TNF FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1998-06-25 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-20030060473-A1 Piperazine compounds as inhibitors of MMP or TNF MMP2, MMP1, TNF MMP1 2/4885MMP13 14/4885MMP3 7/4885

“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.