SCHEMBL2269853

SCHEMBL2269853

O=Cc1ccccc1S(=O)(=O)c1ccc(Cl)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.52
CYP3A4 P08684 1/20 0.52
MAPK1 P28482 1/20 0.52
HTT P42858 2/20 0.47
TSHR P16473 1/20 0.47
CNR2 P34972 1/20 0.47
KDM4E B2RXH2 2/20 0.45
PKM P14618 1/20 0.45
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
HSD11B1 P28845 3/20 0.44
POLB P06746 1/20 0.44
KIF18A Q8NI77 1/20 0.43
NFE2L2 Q16236 1/20 0.42
LMNA P02545 1/20 0.41
THRB P10828 1/20 0.41
BLM P54132 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
HPGD P15428 1/20 0.41
ALOX15 P16050 1/20 0.41

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
SCHEMBL709683 0.85 TSHR (0.62) ALDH1A1HTTTSHRKDM4EMEN1
SCHEMBL10869745 0.82 ALDH1A1 (0.68) ALDH1A1CYP3A4MAPK1HTTCNR2
SCHEMBL1468205 0.82 CYP2D6 (0.50) ALDH1A1HTTTSHRMEN1KMT2A
SCHEMBL3166437 0.82 HTT (0.47) ALDH1A1HTTTSHRMEN1KMT2A
SCHEMBL5879758 0.82 CYP2C9 (0.55) ALDH1A1MAPK1HTTTSHRKDM4E
SCHEMBL16494906 0.81 NFE2L2 (0.49) ALDH1A1HTTTSHRCNR2MEN1
SCHEMBL1465612 0.79 KIF18A (0.51) ALDH1A1CYP3A4MAPK1HTTTSHR
SCHEMBL1466470 0.78 TDP1 (0.50) ALDH1A1CNR2MEN1KMT2AHSD11B1
SCHEMBL16220186 0.78 KMT2A (0.50) ALDH1A1HTTTSHRMEN1KMT2A
SCHEMBL16494957 0.78 PKM (0.56) ALDH1A1HTTPKMPOLBLMNA

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 31 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110117264-A Phenyl sulfone derivative and its application on drug 广东东阳光药业有限公司 2019-08-13 CN disclosed
EP-2526945-A1 New CRTH2 Antagonists Almirall, S.A. (ES) 2012-11-28 EP disclosed
US-8268878-B2 Compounds having CRTH2 antagonist activity OXAGEN LIMITED (GB) 2012-09-18 US disclosed
EP-2492268-A1 Compounds having CRTH2 antagonist activity Oxagen Limited (GB) 2012-08-29 EP disclosed
EP-2046740-B1 COMPOUNDS HAVING CRTH2 ANTAGONIST ACTIVITY OXAGEN LTD (GB) 2012-05-23 EP disclosed
US-20110268693-A1 Compounds Having CRTH2 Antagonist Activity OXAGEN LIMITED (GB) 2011-11-03 US disclosed
US-7999119-B2 Compounds having CRTH2 antagonist activity OXAGEN LIMITED (GB) 2011-08-16 US disclosed
US-7994154-B2 Substituted liposaccharides useful in the treatment and prevention of endotoxemia Ersai R&D Management Co., Ltd. (JP) 2011-08-09 US disclosed
US-20100227835-A1 SUBSTITUTED LIPOSACCHARIDES USEFUL IN THE TREATMENT AND PREVENTION OF ENDOTOXEMIA EISAI R&D MANAGEMENT CO., LTD (JP) 2010-09-09 US disclosed
US-7737129-B2 Substituted liposaccharides useful in the treatment and prevention of endotoxemia EISAI R & D MANAGEMENT CO., LTD. (JP) 2010-06-15 US disclosed
US-6184366-B1 COMPOUND OF DEFINED STRUCTURE WHICH IS CHEMICAL INTERMEDIATE EISAI CO., LTD (JP) 2001-02-06 US disclosed
US-5952309-A ADMINISTERING NOVEL ANALOGS OF LIPID A WHICH ACT AS ENDOTOXIN ANTAGONISTS EISAI COMPANY, LTD. (JP) 1999-09-14 US disclosed
US-5935938-A TREATMENT OF SEPSIS EISAI CO., LTD. (JP) 1999-08-10 US disclosed
EP-0853627-A4 SUBSTITUTED LIPOSACCHARIDES USEFUL IN THE TREATMENT AND PREVENTION OF ENDOTOXEMIA EISAI CO LTD (JP) 1998-10-07 EP disclosed
EP-0853627-A1 SUBSTITUTED LIPOSACCHARIDES USEFUL IN THE TREATMENT AND PREVENTION OF ENDOTOXEMIA Eisai Co., Ltd. (JP) 1998-07-22 EP disclosed
US-5750664-A Substituted liposaccharides useful in the treatment and prevention of endotoxemia EISAI CO., LTD. (JP) 1998-05-12 US disclosed
US-5681824-A Substituted liposaccharides useful in the treatment and prevention of endotoxemia EISAI CO., LTD. (JP) 1997-10-28 US disclosed
WO-1997011708-A9 METHOD FOR TREATING ALCOHOLIC LIVER DISEASE 1997-05-15 WO disclosed
WO-1997011708-A1 METHOD FOR TREATING ALCOHOLIC LIVER DISEASE EISAI RESEARCH INSTITUTE (US) 1997-04-03 WO disclosed
WO-1996039411-A1 SUBSTITUTED LIPOSACCHARIDES USEFUL IN THE TREATMENT AND PREVENTION OF ENDOTOXEMIA EISAI CO., LTD. (JP) 1996-12-12 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-20100227835-A1 SUBSTITUTED LIPOSACCHARIDES USEFUL IN THE TREATMENT AND PREVENTION OF ENDOTOXEMIA LIPG, FUT6, UGCG ALDH1A1 1479/4885CYP3A4 2918/4885MAPK1 3870/4885
US-20110268693-A1 Compounds Having CRTH2 Antagonist Activity HRH2, HRH1, HRH4 ALDH1A1 1293/4885CYP3A4 960/4885MAPK1 2087/4885

“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.