SCHEMBL2299329

SCHEMBL2299329

N#Cc1ccc(S(=O)(=O)N2CCC3(CC2)OCCO3)cc1

nearest known ligand 0.71

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.71
POLB P06746 3/20 0.68
PKM P14618 2/20 0.59
PKLR P30613 1/20 0.56
ALDH1A1 P00352 3/20 0.54
L3MBTL1 Q9Y468 2/20 0.51
GAA P10253 1/20 0.51
MAPK1 P28482 2/20 0.51
SMN1; SMN2 Q16637 2/20 0.51
MEN1 O00255 1/20 0.51
USP2 O75604 1/20 0.51
CYP3A4 P08684 1/20 0.51
KMT2A Q03164 1/20 0.51
HIF1A Q16665 1/20 0.51
LMNA P02545 1/20 0.50
ATM Q13315 1/20 0.49

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
SCHEMBL12793323 0.82 KDM4E (0.79) KDM4EPOLBPKMALDH1A1L3MBTL1
SCHEMBL12655731 0.81 L3MBTL1 (0.54) KDM4EPOLBPKMPKLRALDH1A1
SCHEMBL12656053 0.81 PKM (0.52) KDM4EPOLBPKMPKLRALDH1A1
SCHEMBL5306415 0.81 POLB (1.00) KDM4EPOLBPKMALDH1A1SMN1; SMN2
SCHEMBL2831202 0.81 KDM4E (0.77) KDM4EPOLBPKMALDH1A1L3MBTL1
SCHEMBL12386397 0.81 KDM4E (0.77) KDM4EPOLBPKMALDH1A1L3MBTL1
SCHEMBL4009309 0.81 KDM4E (0.77) KDM4EPOLBPKMALDH1A1L3MBTL1
SCHEMBL2080837 0.81 KDM4E (0.77) KDM4EPOLBPKMALDH1A1L3MBTL1
SCHEMBL6154077 0.80 POLB (1.00) KDM4EPOLBPKMALDH1A1L3MBTL1
SCHEMBL5338240 0.80 POLB (0.67) POLBPKMPKLRALDH1A1L3MBTL1

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
US-8008341-B2 Central nervous system disorders; autoimmune diseases; anticancer agents; cardiovascular disorders; antiischemic agents; antiepileptic agents ; Alzheimer's disease; Huntington's disease; Parkinson's disease; spinal cord injuries; antiarthritic agents; transplant rejection; sepsis; brain disorders MERCK SERONO SA (CH) 2011-08-30 US disclosed
EP-1320526-B1 PHARMACEUTICALLY ACTIVE BENZSULFONAMIDE DERIVATIVES AS INHIBITORS OF PROTEIN JUNKINASES MERCK SERONO SA (CH) 2010-08-18 EP disclosed
US-20080255222-A1 PHARMACEUTICALLY ACTIVE BENZSULFONAMIDE DERIVATIVES AS INHIBITORS OF PROTEIN JUNKINASES APPLIED RESEARCH SYSTEMS ARS HOLDING N.V. (NL) 2008-10-16 US disclosed
US-7417058-B2 Pharmaceutically active benzsulfonamide derivatives as inhibitors of protein junkinases LABORATOIRES SERONO S.A. (CH) 2008-08-26 US disclosed
US-20040053917-A1 Pharmaceutically active benzsulfonamide derivatives as inhibitors of protein junkinases MERCK SERONO SA (CH) 2004-03-18 US disclosed
EP-1320526-A1 PHARMACEUTICALLY ACTIVE BENZSULFONAMIDE DERIVATIVES AS INHIBITORS OF PROTEIN JUNKINASES Applied Research Systems ARS Holding N.V. (AN) 2003-06-25 EP disclosed
WO-2002026711-A1 PHARMACEUTICALLY ACTIVE BENZSULFONAMIDE DERIVATIVES AS INHIBITORS OF PROTEIN JUNKINASES APPLIED RESEARCH SYSTEMS ARS HOLDING N.V. (AN) 2002-04-04 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-20040053917-A1 Pharmaceutically active benzsulfonamide derivatives as inhibitors of protein junkinases MAPK3, CBR3, MAPK1 KDM4E 2172/4885POLB 4788/4885PKM 2512/4885
US-20080255222-A1 PHARMACEUTICALLY ACTIVE BENZSULFONAMIDE DERIVATIVES AS INHIBITORS OF PROTEIN JUNKINASES MAP3K5, MAP3K2, MAP3K21 KDM4E 1305/4885POLB 3958/4885PKM 465/4885

“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.