SCHEMBL4928405

SCHEMBL4928405

CC(=O)c1cccc(-c2ccc(N(CC(=O)O)S(C)(=O)=O)cc2)c1

nearest known ligand 0.58

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.58
TSHR P16473 1/20 0.58
SMN1; SMN2 Q16637 2/20 0.53
MEN1 O00255 2/20 0.50
GAA P10253 1/20 0.49
ALDH1A1 P00352 2/20 0.47
CYP3A4 P08684 1/20 0.47
CYP2D6 P10635 1/20 0.47
CYP2C9 P11712 1/20 0.47
ALOX15 P16050 1/20 0.47
CYP2C19 P33261 1/20 0.47
MAPT P10636 2/20 0.46
NPSR1 Q6W5P4 1/20 0.46
LMNA P02545 1/20 0.45
PHGDH O43175 1/20 0.43
F10 P00742 2/20 0.43
PTGS2 P35354 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.42

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
SCHEMBL4933383 0.86 SMN1; SMN2 (0.57) KMT2ATSHRSMN1; SMN2MEN1GAA
SCHEMBL24445700 0.85 KMT2A (0.64) KMT2ATSHRSMN1; SMN2MEN1GAA
SCHEMBL4934333 0.85 SMN1; SMN2 (0.70) KMT2ATSHRSMN1; SMN2ALDH1A1PHGDH
SCHEMBL2558736 0.82 SMN1; SMN2 (0.61) KMT2ATSHRSMN1; SMN2MEN1GAA
SCHEMBL4934321 0.80 SMN1; SMN2 (0.51) SMN1; SMN2PHGDH
SCHEMBL4935879 0.78 KEAP1 (0.65) KMT2ASMN1; SMN2MEN1ALDH1A1MAPT
SCHEMBL697566 0.75 SMN1; SMN2 (0.73) KMT2ATSHRSMN1; SMN2MEN1GAA
SCHEMBL5686773 0.75 SMN1; SMN2 (0.45) KMT2ATSHRSMN1; SMN2ALDH1A1
SCHEMBL4930573 0.75 SMN1; SMN2 (0.54) KMT2ASMN1; SMN2GAAPHGDHPTGS2
SCHEMBL4927214 0.74 KEAP1 (0.68) SMN1; SMN2ALDH1A1LMNA

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-20080227858-A1 Inhibitors of matrix metalloproteinase GLAXO GROUP LIMITED 2008-09-18 US disclosed
US-20080227858-A1 Inhibitors of matrix metalloproteinase GLAXO GROUP LIMITED 2008-09-18 US disclosed
US-20080227858-A1 Inhibitors of matrix metalloproteinase GLAXO GROUP LIMITED 2008-09-18 US disclosed
US-7375248-B2 Inhibitors of matrix metalloproteinase GLAXO GROUP LIMITED (GB) 2008-05-20 US disclosed
US-7375248-B2 Inhibitors of matrix metalloproteinase GLAXO GROUP LIMITED (GB) 2008-05-20 US disclosed
US-7375248-B2 Inhibitors of matrix metalloproteinase GLAXO GROUP LIMITED (GB) 2008-05-20 US disclosed
US-20060142385-A1 Inhibitors of matrix metalloproteinase GLAXO GROUP LIMITED (GB) 2006-06-29 US disclosed
WO-2004113279-A1 INHIBITORS OF MATRIX METALLOPROTEINASE GLAXO GROUP LIMITED (GB) 2004-12-29 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-20060142385-A1 Inhibitors of matrix metalloproteinase MMP9, MMP13, MMP26 KMT2A 3816/4885TSHR 87/4885SMN1; SMN2 3337/4885
US-20080227858-A1 Inhibitors of matrix metalloproteinase MMP9, MMP13, MMP2 KMT2A 3840/4885TSHR 101/4885SMN1; SMN2 3365/4885

“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.