SCHEMBL216889

SCHEMBL216889

Cc1cc(C)c(S(=O)(=O)n2cnc([N+](=O)[O-])n2)c(C)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.56
NPSR1 Q6W5P4 3/20 0.41
MAPK1 P28482 1/20 0.40
RAPGEF4 Q8WZA2 7/20 0.39
PIK3CD O00329 1/20 0.38
PIK3CA P42336 1/20 0.38
PIK3CB P42338 1/20 0.38
PIK3CG P48736 1/20 0.38
THRB P10828 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
MAPT P10636 1/20 0.37
HTT P42858 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
GAA P10253 2/20 0.36
LMNA P02545 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C9 P11712 1/20 0.36
PKM P14618 1/20 0.36

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
SCHEMBL27870034 0.82 KDM4E (0.43) ALDH1A1THRBSMN1; SMN2MAPTHTT
SCHEMBL1123625 0.79 KMT2A (0.43) ALDH1A1MAPK1SMN1; SMN2MAPTHTT
SCHEMBL5694172 0.76 POLB (0.41) ALDH1A1RAPGEF4THRBSMN1; SMN2HTT
SCHEMBL1123484 0.76 FABP4 (0.47) ALDH1A1NPSR1PIK3CDPIK3CAPIK3CB
SCHEMBL29101321 0.75 KDM4E (0.57) ALDH1A1THRBSMN1; SMN2MAPTHTT
SCHEMBL3245827 0.75 POLB (0.42) ALDH1A1PIK3CATHRBSMN1; SMN2MAPT
SCHEMBL30614582 0.75 HTT (0.43) ALDH1A1SMN1; SMN2MAPTHTTLMNA
SCHEMBL27668876 0.75 ALDH1A1 (0.37) ALDH1A1NPSR1THRBSMN1; SMN2GAA
SCHEMBL13490192 0.74 MAPK1 (0.42) ALDH1A1NPSR1MAPK1RAPGEF4PIK3CD
SCHEMBL9832274 0.73 ALDH1A1 (0.40) ALDH1A1NPSR1SMN1; SMN2HTTGAA

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 1438 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220125821-A1 CYCLIC DINUCLEOTIDE PRODRUG MOLECULE, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF SHENZHEN YING BIOPHARMACEUTICAL CO., LTD. (CN) 2022-04-28 US claimed
EP-3087093-B1 PHARMACEUTICALLY RELEVANT AROMATIC-CATIONIC PEPTIDES STEALTH BIOTHERAPEUTICS CORP (MC) 2021-11-10 EP claimed
EP-3901161-A1 CYCLIC DINUCLEOTIDE PRODRUG MOLECULE, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF Nankai University (CN) 2021-10-27 EP claimed
CN-112457368-A Pharmaceutically-related aromatic-cationic peptides 康德生物医疗技术公司 2021-03-09 CN claimed
CN-106132984-B Pharmaceutically-related aromatic-cationic peptides 康德生物医疗技术公司 2020-12-08 CN claimed
US-10696716-B2 Pharmaceutically relevant aromatic-cationic peptides STEALTH BIOTHERAPEUTICS CORP (MC) 2020-06-30 US claimed
US-20200024308-A1 PHARMACEUTICALLY RELEVANT AROMATIC-CATIONIC PEPTIDES STEALTH BIOTHERAPEUTICS CORP (MC) 2020-01-23 US claimed
US-10221213-B2 Pharmaceutically relevant aromatic-cationic peptides STEALTH BIOTHERAPEUTICS CORP (MC) 2019-03-05 US claimed
US-20170081363-A1 PHARMACEUTICALLY RELEVANT AROMATIC-CATIONIC PEPTIDES STEALTH BIOTHERAPEUTICS CORP (MC) 2017-03-23 US claimed
EP-3114136-A1 PHARMACEUTICALLY RELEVANT AROMATIC-CATIONIC PEPTIDES Stealth BioTherapeutics Corp (MC) 2017-01-11 EP claimed
US-20090005369-A1 Oxazolidinone Compounds and Compositions and Methods Related Thereto FERRER INTERNACIONAL S.A. (ES) 2009-01-01 US claimed
US-20080303439-A1 Coating composition for interconnection part of electrode and plasma display panel including the same SAMSUNG SDI CO., LTD., A CORP. OF THE REPUBLIC OF KOREA (KR) 2008-12-11 US claimed
US-20080045694-A1 Preparation of Solid Phase Bound Peptides or Pnas DEUTSCHES KREBSFORSCHUNGSZENTRUM STIFTUNG DES OFFENTLICHEN RECHTS (DE) 2008-02-21 US claimed
EP-1786805-A1 OXAZOLIDINONE COMPOUNDS AND COMPOSITIONS AND METHODS RELATED THERETO FERRER INTERNACIONAL, S.A. (ES) 2007-05-23 EP claimed
EP-1749019-A1 PREPARATION OF SOLID PHASE BOUND PEPTIDES OR PNAS Deutsches Krebsforschungszentrum Stiftung des öffentlichen Rechts (DE) 2007-02-07 EP claimed
WO-2006010756-A1 OXAZOLIDINONE COMPOUNDS AND COMPOSITIONS AND METHODS RELATED THERETO FERRER INTERNACIONAL, S. A. (ES) 2006-02-02 WO claimed
US-20060019366-A1 Reversibly modified thermostable enzyme compositions and methods of making and using the same BI WANLI 2006-01-26 US claimed
WO-2005123913-A2 REVERSIBLY MODIFIED THERMOSTABLE ENZYME COMPOSITIONS AND METHODS OF MAKING AND USING THE SAME NUSTAR LABORATORY (US) 2005-12-29 WO claimed
WO-2005118616-A1 PREPARATION OF SOLID PHASE BOUND PEPTIDES OR PNAS Deutsches Krebsforschungszentrum Stiftung des öffentlichen Rechts (DE) 2005-12-15 WO claimed
US-6153742-A SOLID PHASE SYNTHESIS PRODUCING ANTISENSE OLIGONUCLEOTIDES UNIVERSITY OF BARCELONA (ES) 2000-11-28 US claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (6 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-20200024308-A1 PHARMACEUTICALLY RELEVANT AROMATIC-CATIONIC PEPTIDES ADM2, VIP, ANPEP ALDH1A1 4716/4885NPSR1 580/4885MAPK1 3212/4885
US-20220125821-A1 CYCLIC DINUCLEOTIDE PRODRUG MOLECULE, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF DPYD, PDE11A, PDE7A ALDH1A1 1183/4885NPSR1 2336/4885MAPK1 3129/4885
US-10221213-B2 Pharmaceutically relevant aromatic-cationic peptides ADM2, VIP, ANPEP ALDH1A1 4716/4885NPSR1 580/4885MAPK1 3212/4885
US-20170081363-A1 PHARMACEUTICALLY RELEVANT AROMATIC-CATIONIC PEPTIDES ADM2, VIP, ANPEP ALDH1A1 4618/4885NPSR1 587/4885MAPK1 2803/4885
US-10696716-B2 Pharmaceutically relevant aromatic-cationic peptides ADM2, VIP, ANPEP ALDH1A1 4716/4885NPSR1 580/4885MAPK1 3212/4885
US-20090005369-A1 Oxazolidinone Compounds and Compositions and Methods Related Thereto OXA1L, MAOA, NR0B1 ALDH1A1 866/4885NPSR1 967/4885MAPK1 1038/4885

“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.