SCHEMBL2155339

SCHEMBL2155339

CCOP(=O)(CS(=O)(=O)N1CCN(c2ccc(Cl)cn2)CC1)OCC

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.44
ALDH1A1 P00352 2/20 0.44
MAPT P10636 1/20 0.44
GPR119 Q8TDV5 3/20 0.44
HSD17B10 Q99714 1/20 0.41
CNR2 P34972 1/20 0.40
SMO Q99835 3/20 0.40
KMT2A Q03164 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
GAA P10253 1/20 0.39
DRD4 P21917 2/20 0.39
DRD2 P14416 1/20 0.38
PANK3 Q9H999 1/20 0.38

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
SCHEMBL4958636 0.83 GPR119 (0.46) KDM4EALDH1A1MAPTGPR119HSD17B10
SCHEMBL15286518 0.77 SMO (0.52) KDM4EALDH1A1MAPTHSD17B10SMO
SCHEMBL4958144 0.75 GPR119 (0.46) KDM4EALDH1A1MAPTGPR119HSD17B10
SCHEMBL2155271 0.75 GPR119 (0.59) ALDH1A1GPR119HSD17B10CNR2SMO
SCHEMBL4754484 0.74 GPR119 (0.54) KDM4EALDH1A1GPR119HSD17B10CNR2
SCHEMBL4958147 0.73 GPR119 (0.44) KDM4EALDH1A1MAPTGPR119CNR2
SCHEMBL2155345 0.73 GPR119 (0.44) KDM4EALDH1A1MAPTGPR119CNR2
SCHEMBL2155087 0.72 ALDH1A1 (0.48) ALDH1A1MAPTKMT2A
SCHEMBL12395361 0.71 LMNA (0.54) ALDH1A1MAPTKMT2AGAADRD2
SCHEMBL7155176 0.70 PANK3 (0.44) KDM4EALDH1A1MAPTGPR119HSD17B10

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-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-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
US-20080194520-A1 Sulfonyl Amino Cyclic Derivatives and Use Thereof MERCK SERONO SA (CH) 2008-08-14 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-20080194520-A1 Sulfonyl Amino Cyclic Derivatives and Use Thereof GLS2, SRM, GLS KDM4E 1965/4885ALDH1A1 2059/4885MAPT 4423/4885

“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.