SCHEMBL7057487

SCHEMBL7057487

COc1ccc(S(=O)(=O)N2CCN(S(C)(=O)=O)[C@@H](C)[C@@H]2C(=O)NOC2CCCCO2)cc1

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 15/20 0.49
MMP13 P45452 9/20 0.49
ADAM17 P78536 1/20 0.49
MMP3 P08254 14/20 0.47
MMP7 P09237 10/20 0.47
POLB P06746 1/20 0.45
MMP9 P14780 9/20 0.45
MMP2 P08253 3/20 0.43
MMP8 P22894 2/20 0.43
HCRTR1 O43613 2/20 0.43
HCRTR2 O43614 2/20 0.43
ALDH1A1 P00352 1/20 0.43
HTT P42858 1/20 0.43
PKM P14618 1/20 0.43

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
SCHEMBL7053311 0.80 MMP1 (0.68) MMP1MMP13ADAM17MMP3MMP7
SCHEMBL7057703 0.80 MMP1 (0.68) MMP1MMP13ADAM17MMP3MMP7
SCHEMBL7053634 0.78 MMP1 (0.55) MMP1MMP13MMP3MMP7MMP9
SCHEMBL7059669 0.76 MMP1 (0.55) MMP1MMP13ADAM17MMP3MMP7
SCHEMBL7054410 0.75 MMP1 (0.57) MMP1MMP13ADAM17MMP3MMP7
SCHEMBL7056491 0.73 MMP13 (0.54) MMP1MMP13ADAM17MMP3MMP7
SCHEMBL17899694 0.72 PKM (0.48) POLBALDH1A1HTTPKM
SCHEMBL7058053 0.71 MMP9 (0.49) MMP1MMP13ADAM17MMP3MMP7
SCHEMBL7059067 0.71 MMP1 (0.49) MMP1MMP13ADAM17MMP3MMP7
SCHEMBL17899692 0.70 PKM (0.46) POLBALDH1A1HTTPKM

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 6 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-20020128270-A1 Piperazine compounds as inhibitors of MMP or TNF FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-09-12 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 (2 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-20020128270-A1 Piperazine compounds as inhibitors of MMP or TNF MMP1, MMP2, TNF MMP1 1/4885MMP13 14/4885ADAM17 26/4885
US-20030060473-A1 Piperazine compounds as inhibitors of MMP or TNF MMP2, MMP1, TNF MMP1 2/4885MMP13 14/4885ADAM17 26/4885

“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.