SCHEMBL3934693

SCHEMBL3934693

O=C(NO)C(CS(=O)(=O)N1CCN(c2ccc(OC(F)(F)C(F)F)cc2)CC1)c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TP53 P04637 3/20 0.46
MAPT P10636 3/20 0.42
MEN1 O00255 1/20 0.42
ALDH1A1 P00352 1/20 0.42
POLB P06746 1/20 0.42
KMT2A Q03164 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
KCNQ2 O43526 1/20 0.39
THRB P10828 2/20 0.39
CHRM4 P08173 1/20 0.37

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
SCHEMBL3935385 0.79 TP53 (0.38) TP53MAPTALDH1A1POLBSMN1; SMN2
SCHEMBL3934688 0.79 MMP2 (0.52) TP53
SCHEMBL3943167 0.78 CYP3A4 (0.43) TP53MAPTMEN1POLBKMT2A
SCHEMBL14019092 0.77 TP53 (0.42) TP53MAPTMEN1POLBKMT2A
SCHEMBL4610993 0.76 LMNA (0.49) MAPTMEN1ALDH1A1KMT2AKCNQ2
SCHEMBL3944035 0.74 MMP13 (0.38) TP53MAPTALDH1A1POLBSMN1; SMN2
SCHEMBL3944032 0.74 MMP13 (0.38) TP53MAPTALDH1A1POLBSMN1; SMN2
SCHEMBL3942288 0.74 MMP13 (0.38) TP53MAPTALDH1A1POLBSMN1; SMN2
SCHEMBL3934827 0.72 MMP13 (0.39) TP53MAPTALDH1A1POLBSMN1; SMN2
SCHEMBL8299383 0.72 MMP13 (0.70) TP53THRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7485644-B2 N-{'4-substituted piperazine-1-sulfonylmethylalkyl}-n-hydroxyfomamide compounds as metalloproteinase inhibitors ASTRAZENECA AB (SE) 2009-02-03 US disclosed
EP-1644340-B1 N-[({'4-SUBSTITUTED PIPERAZINE-1-YL}SULFONYLMETHYL)ALKYL]-N-HYDROXYFORMAMIDE COMPOUNDS AS METALLOPROTEINASE INHIBITORS ASTRAZENECA AB (SE) 2008-11-12 EP disclosed
US-20070197542-A1 N-{'4-substituted piperazine-1-sulfonylmethyl!alkyl}-n-hydroxyfomamide compounds as metalloproteinase inhibitors ASTRAZENECA AB (SE) 2007-08-23 US 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-20070197542-A1 N-{'4-substituted piperazine-1-sulfonylmethyl!alkyl}-n-hydroxyfomamide compounds as metalloproteinase inhibitors MMP26, MMP9, MMP3 TP53 1779/4885MAPT 4413/4885MEN1 786/4885

“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.