SCHEMBL909752

SCHEMBL909752

Cc1ccc(S(=O)(=O)O)c(C[C@H]2CO2)c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.38
MEN1 O00255 2/20 0.38
MEP1B Q16820 1/20 0.35
RAPGEF4 Q8WZA2 1/20 0.34
LMNA P02545 1/20 0.34
CA2 P00918 1/20 0.34
ALDH1A1 P00352 3/20 0.33
KDM4E B2RXH2 1/20 0.33
MAPK1 P28482 1/20 0.33
GAA P10253 1/20 0.33
TSHR P16473 1/20 0.33
POLB P06746 1/20 0.33
ATM Q13315 1/20 0.33
NR3C1 P04150 1/20 0.33
PGR P06401 1/20 0.33
NR3C2 P08235 1/20 0.33
HPGD P15428 1/20 0.33
HSD17B10 Q99714 1/20 0.33
CTSB P07858 1/20 0.33
NCOA3 Q9Y6Q9 1/20 0.32

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
SCHEMBL537494 1.00 KMT2A (0.38) KMT2AMEN1MEP1BRAPGEF4LMNA
SCHEMBL909187 1.00 KMT2A (0.38) KMT2AMEN1MEP1BRAPGEF4LMNA
SCHEMBL3812470 0.93 MEN1 (0.34) KMT2AMEN1MEP1BRAPGEF4LMNA
SCHEMBL3809686 0.93 MEN1 (0.34) KMT2AMEN1MEP1BRAPGEF4LMNA
SCHEMBL5153705 0.92 ALDH1A1 (0.33) KMT2AMEN1MEP1BRAPGEF4LMNA
SCHEMBL20184269 0.89 ALDH1A1 (0.44) KMT2AMEN1LMNAALDH1A1KDM4E
SCHEMBL27206070 0.88 KDM4E (0.39) KMT2AMEP1BLMNAALDH1A1KDM4E
SCHEMBL30321034 0.87 PRMT5 (0.42) KMT2AMEN1LMNAALDH1A1MAPK1
SCHEMBL32681961 0.87 SLC6A2 (0.37) KMT2AMEN1MEP1BLMNAALDH1A1
SCHEMBL4795645 0.85 CA2 (0.39) KMT2AMEN1LMNACA2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0485894-B1 Methods for the preparation of semi-synthetic diastereomerically pure N-glycidyl-anthracyclines HOECHST AG (DE) 1999-02-03 EP claimed
EP-0485894-A1 Semi-synthetic diastereomerically pure N-glycidyl-anthracyclines, methods for their preparation, and their use as cytostatics BEHRINGWERKE Aktiengesellschaft (DE) 1992-05-20 EP claimed
US-11229646-B2 Method for treating gonorrhea with (2R)-2-({4-[(3,4-dihydro-2H-pyrano[2,3-C]pyridin-6-ylmethyl)amino]-1-piperidinyl}methyl)-1,2-dihydro-3H,8H-2A,5,8A-triazaacenaphthylene-3,8-dione GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED 2022-01-25 US disclosed
US-20200330462-A1 TRICYCLIC NITROGEN CONTAINING COMPOUNDS FOR TREATING NEISSERIA GONORRHOEA INFECTION GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2020-10-22 US disclosed
US-10702521-B2 Methods for treating neisseria gonorrhoeae infection with substituted 1,2-dihydro-2A,5,8A-triazaacenaphthylene-3,8-diones GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2020-07-07 US disclosed
EP-3639824-A1 TRICYCLIC NITROGEN CONTAINING COMPOUNDS FOR TREATING NEISSERIA GONORRHOEA INFECTION GlaxoSmithKline Intellectual Property Development Limited (GB) 2020-04-22 EP disclosed
EP-3182973-B1 TRICYCLIC NITROGEN CONTAINING COMPOUNDS FOR TREATING NEISSERIA GONORRHOEA INFECTION GLAXOSMITHKLINE IP DEV LTD (GB) 2019-09-18 EP disclosed
US-20170304301-A1 TRICYCLIC NITROGEN CONTAINING COMPOUNDS FOR TREATING NEISSERIA GONORRHOEA INFECTION GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2017-10-26 US disclosed
EP-3182973-A1 TRICYCLIC NITROGEN CONTAINING COMPOUNDS FOR TREATING NEISSERIA GONORRHOEA INFECTION GlaxoSmithKline Intellectual Property Development Limited (GB) 2017-06-28 EP disclosed
WO-2016027249-A1 TRICYCLIC NITROGEN CONTAINING COMPOUNDS FOR TREATING NEISSERIA GONORRHOEA INFECTION GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2016-02-25 WO disclosed
US-9051331-B2 Substituted dihydro benzocycloalkyloxymethyl oxazolopyrimidinones, preparation and use thereof SANOFI (FR) 2015-06-09 US disclosed
WO-1995002584-A2 PROCESS FOR MAKING HIV PROTEASE INHIBITORS MERCK & CO., INC. (US) 1995-01-26 WO disclosed
WO-1994003425-A2 CARBOSTYRIL DERIVATIVES FOR THE TREATMENT OF ARRHYTHMIA SYNTEX (U.S.A.) INC. (US) 1994-02-17 WO disclosed
US-5264596-A Isotactic poly(glycidyl nitrate) and synthesis thereof THIOKOL CORPORATION (US) 1993-11-23 US disclosed
EP-0518110-A2 Process for the preparation of pure enatiomers of 4-[4-(4'-tert.butylphenyl)-2-hydroxybutoxy]-benzoic acid and its alkyl ester Klinge Pharma GmbH (DE) 1992-12-16 EP disclosed
US-5162494-A ISOTACTIC POLY(GLYDICYL NITRATE) AND SYNTHESIS THEREOF THIOKOL CORPORATION (US) 1992-11-10 US disclosed
EP-0485894-A1 Semi-synthetic diastereomerically pure N-glycidyl-anthracyclines, methods for their preparation, and their use as cytostatics BEHRINGWERKE Aktiengesellschaft (DE) 1992-05-20 EP disclosed
EP-0485099-A1 Isotactic poly(glycidyl nitrate) and synthesis thereof THIOKOL CORPORATION (US) 1992-05-13 EP disclosed
EP-0467325-A2 Carbostyril derivatives SYNTEX (U.S.A.) INC. (US) 1992-01-22 EP disclosed
US-5082847-A Antiarrhythmia SYNTEX (U.S.A.) INC. (US) 1992-01-21 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 (4 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-20200330462-A1 TRICYCLIC NITROGEN CONTAINING COMPOUNDS FOR TREATING NEISSERIA GONORRHOEA INFECTION NME2, NNMT, NGLY1 KMT2A 3610/4885MEN1 1686/4885MEP1B 3033/4885
US-10702521-B2 Methods for treating neisseria gonorrhoeae infection with substituted 1,2-dihydro-2A,5,8A-triazaacenaphthylene-3,8-diones DHPS, HSD17B11, GNE KMT2A 2573/4885MEN1 1673/4885MEP1B 2879/4885
US-11229646-B2 Method for treating gonorrhea with (2R)-2-({4-[(3,4-dihydro-2H-pyrano[2,3-C]pyridin-6-ylmethyl)amino]-1-piperidinyl}methyl)-1,2-dihydro-3H,8H-2A,5,8A-triazaacenaphthylene-3,8-dione GMPS, GNE, DHPS KMT2A 1748/4885MEN1 2729/4885MEP1B 2735/4885
US-20170304301-A1 TRICYCLIC NITROGEN CONTAINING COMPOUNDS FOR TREATING NEISSERIA GONORRHOEA INFECTION NME2, NNMT, NGLY1 KMT2A 3610/4885MEN1 1686/4885MEP1B 3033/4885

“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.