SCHEMBL2297718

SCHEMBL2297718

NCc1ccc(S(=O)(=O)N2CCC3(CC2)OCCO3)cc1

nearest known ligand 0.71

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.71
POLB P06746 3/20 0.68
PKM P14618 1/20 0.59
ALDH1A1 P00352 4/20 0.57
SMN1; SMN2 Q16637 3/20 0.53
LMNA P02545 2/20 0.53
MAPK1 P28482 1/20 0.53
L3MBTL1 Q9Y468 2/20 0.49
ATM Q13315 1/20 0.49
NPC1 O15118 1/20 0.48
RAB9A P51151 1/20 0.48
GAA P10253 1/20 0.47

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
SCHEMBL12386402 0.92 KDM4E (0.59) KDM4EPOLBPKMALDH1A1SMN1; SMN2
SCHEMBL12386397 0.84 KDM4E (0.77) KDM4EPOLBPKMALDH1A1SMN1; SMN2
SCHEMBL12622062 0.82 L3MBTL1 (0.55) KDM4EPOLBALDH1A1L3MBTL1
SCHEMBL12793323 0.82 KDM4E (0.79) KDM4EPOLBPKMALDH1A1SMN1; SMN2
SCHEMBL27839480 0.81 USP2 (0.61) POLBPKMALDH1A1SMN1; SMN2NPC1
SCHEMBL5306415 0.81 POLB (1.00) KDM4EPOLBPKMALDH1A1SMN1; SMN2
SCHEMBL4009309 0.81 KDM4E (0.77) KDM4EPOLBPKMALDH1A1SMN1; SMN2
SCHEMBL2080837 0.81 KDM4E (0.77) KDM4EPOLBPKMALDH1A1SMN1; SMN2
SCHEMBL2831202 0.81 KDM4E (0.77) KDM4EPOLBPKMALDH1A1SMN1; SMN2
SCHEMBL15231957 0.80 POLB (0.67) KDM4EPOLBALDH1A1SMN1; SMN2LMNA

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 10 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
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-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-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.