SCHEMBL7056552

SCHEMBL7056552

CCN(C)S(=O)(=O)N1CCN(S(=O)(=O)c2ccc(-c3ccc(Cl)cc3)s2)[C@@H](C(=O)NOC2CCCCO2)C1

nearest known ligand 0.34

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.34
MEN1 O00255 3/20 0.34
ALDH1A1 P00352 3/20 0.33
MCHR1 Q99705 1/20 0.32
MMP13 P45452 6/20 0.32
MMP8 P22894 1/20 0.32
MMP12 P39900 1/20 0.32
MMP1 P03956 3/20 0.32
KCNQ1 P51787 1/20 0.31
CCNA2 P20248 1/20 0.31
CDK2 P24941 1/20 0.31
CCNA1 P78396 1/20 0.31
CDK5 Q00535 1/20 0.31
CDK5R1 Q15078 1/20 0.31
HTT P42858 1/20 0.31

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
SCHEMBL7057127 0.93 KMT2A (0.35) KMT2AMEN1ALDH1A1MCHR1MMP13
SCHEMBL7053089 0.89 MMP13 (0.38) KMT2AMEN1ALDH1A1MMP13MMP8
SCHEMBL7059167 0.88 GAA (0.37) KMT2AMEN1ALDH1A1MMP13MMP1
SCHEMBL7056052 0.86 MMP13 (0.38) ALDH1A1MCHR1MMP13MMP1KCNQ1
SCHEMBL7352584 0.86 MMP13 (0.42) MMP13MMP1
SCHEMBL7052572 0.86 SMN1; SMN2 (0.35) KMT2AMEN1ALDH1A1MCHR1MMP13
SCHEMBL7055721 0.86 SMN1; SMN2 (0.34) KMT2AALDH1A1MCHR1MMP13MMP8
SCHEMBL7057502 0.86 ALDH1A1 (0.38) KMT2AALDH1A1MMP13MMP1HTT
SCHEMBL7058573 0.85 MMP13 (0.35) KMT2AMEN1ALDH1A1MMP13MMP8
SCHEMBL7056089 0.85 KMT2A (0.38) KMT2AMEN1ALDH1A1MMP13MMP8

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 KMT2A 1432/4885MEN1 3998/4885ALDH1A1 281/4885

“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.