SCHEMBL2155668

SCHEMBL2155668

COc1ccccc1N1CCN(S(C)(=O)=O)CC1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.71
GFER P55789 2/20 0.71
ALDH1A1 P00352 4/20 0.66
POLB P06746 3/20 0.66
TP53 P04637 1/20 0.66
SMN1; SMN2 Q16637 6/20 0.64
LMNA P02545 4/20 0.64
MAPK1 P28482 3/20 0.64
TSHR P16473 3/20 0.64
USP2 O75604 1/20 0.64
GLA P06280 1/20 0.64
HSD17B10 Q99714 1/20 0.64
NPSR1 Q6W5P4 2/20 0.63
HPGD P15428 1/20 0.63
DRD2 P14416 1/20 0.63
DRD3 P35462 1/20 0.63
KMT2A Q03164 3/20 0.61
HTT P42858 1/20 0.60
MEN1 O00255 1/20 0.60
PKM P14618 1/20 0.59

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
SCHEMBL2966619 0.87 GAA (0.71) GAAGFERALDH1A1POLBTP53
Hydrochloric Acid SCHEMBL5502387 0.86 GAA (0.69) GAAGFERALDH1A1POLBTP53
SCHEMBL24159575 0.83 GAA (0.66) GAAGFERALDH1A1POLBTP53
SCHEMBL14972819 0.82 KMT2A (0.61) GAAGFERALDH1A1POLBTP53
SCHEMBL17308220 0.80 SMN1; SMN2 (0.56) GAAGFERALDH1A1SMN1; SMN2LMNA
SCHEMBL11508895 0.80 GAA (0.82) GAAGFERALDH1A1POLBTP53
SCHEMBL2950399 0.80 SMN1; SMN2 (0.74) GAAGFERALDH1A1POLBTP53
SCHEMBL6187316 0.79 DRD2 (0.81) GAAGFERALDH1A1POLBTP53
SCHEMBL8984896 0.79 ALDH1A1 (0.53) GAAGFERALDH1A1POLBTP53
SCHEMBL5255516 0.79 GAA (0.80) GAAGFERALDH1A1POLBTP53

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
EP-1828160-B1 SULFONYL AMINO CYCLIC DERIVATIVES AND USE THEREOF AS MMP INHIBITORS MERCK SERONO SA (CH) 2011-12-14 EP disclosed
US-7973039-B2 3-(1,3-benzodioxol-5-yl)-1-({[4-(4-fluorophenyl)-1-piperazinyl]sulfonyl}methyl)-2-propynyl(hydroxy)formamide; analgesics, anticarcinogenic agents, antiarthritic agents; matrix metalloproteinase inhhibitors MERCK SERONO SA (CH) 2011-07-05 US disclosed
US-20080194520-A1 Sulfonyl Amino Cyclic Derivatives and Use Thereof MERCK SERONO SA (CH) 2008-08-14 US disclosed
CN-101124213-A Sulfonylamino cyclic derivatives and uses thereof SERONO LAB (CH) 2008-02-13 CN disclosed
EP-1828160-A1 SULFONYL AMINO CYCLIC DERIVATIVES AND USE THEREOF AS MMP INHIBITORS LABORATOIRES SERONO S.A. (CH) 2007-09-05 EP disclosed
WO-2006067114-A1 SULFONYL AMINO CYCLIC DERIVATIVES AND USE THEREOF LABORATOIRES SERONO S.A. (CH) 2006-06-29 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 (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-20080194520-A1 Sulfonyl Amino Cyclic Derivatives and Use Thereof GLS2, SRM, GLS GAA 2816/4885GFER 149/4885ALDH1A1 2059/4885

“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.