SCHEMBL2155368

SCHEMBL2155368

CCCCCC#CC(CS(=O)(=O)N1CCN(c2ccc(OCc3ccccc3)cc2)CC1)NC(=O)O

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.42
KDM4E B2RXH2 1/20 0.42
POLB P06746 1/20 0.41
HTT P42858 2/20 0.41
ALDH1A1 P00352 1/20 0.41
LMNA P02545 1/20 0.41
AR P10275 1/20 0.40
ATM Q13315 1/20 0.40
RAB9A P51151 1/20 0.40
CTRC Q99895 1/20 0.39
PRMT5 O14744 1/20 0.39
ACACB O00763 1/20 0.39
FFAR1 O14842 1/20 0.39
PTGDR Q13258 1/20 0.38
HPGD P15428 1/20 0.38
TDP1 Q9NUW8 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
SCHEMBL2156207 0.92 AR (0.41) MAPTKDM4EPOLBHTTALDH1A1
SCHEMBL2154976 0.91 POLB (0.44) MAPTKDM4EPOLBALDH1A1LMNA
SCHEMBL2155476 0.88 POLB (0.42) MAPTKDM4EPOLBALDH1A1LMNA
SCHEMBL2155117 0.84 CYP3A4 (0.46) KDM4EPOLBALDH1A1LMNA
SCHEMBL2155145 0.84 KDM4E (0.40) MAPTKDM4EPOLB
SCHEMBL16493547 0.83 AR (0.39) MAPTKDM4EPOLBHTTALDH1A1
SCHEMBL2155365 0.82 CYP3A4 (0.44) MAPTKDM4EPOLBHTTALDH1A1
SCHEMBL2156547 0.82 TP53 (0.43) MAPTKDM4EPOLBLMNA
SCHEMBL2156665 0.82 CYP3A4 (0.47) KDM4EPOLBALDH1A1LMNA
SCHEMBL2155465 0.81 POLB (0.39) MAPTKDM4EPOLBLMNA

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 7 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 claimed
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 claimed
US-20080194520-A1 Sulfonyl Amino Cyclic Derivatives and Use Thereof MERCK SERONO SA (CH) 2008-08-14 US claimed
EP-1828160-A1 SULFONYL AMINO CYCLIC DERIVATIVES AND USE THEREOF AS MMP INHIBITORS LABORATOIRES SERONO S.A. (CH) 2007-09-05 EP claimed
WO-2006067114-A1 SULFONYL AMINO CYCLIC DERIVATIVES AND USE THEREOF LABORATOIRES SERONO S.A. (CH) 2006-06-29 WO claimed
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

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 MAPT 4423/4885KDM4E 1965/4885POLB 4343/4885

“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.