SCHEMBL720606

SCHEMBL720606

C=CCS(=O)(=O)NCCCCC

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 4/20 0.48
CA1 P00915 4/20 0.46
CA2 P00918 4/20 0.46
CA12 O43570 1/20 0.45
CA7 P43166 1/20 0.45
CA14 Q9ULX7 1/20 0.45
EPHX1 P07099 2/20 0.44
RELA Q04206 4/20 0.44
ZDHHC20 Q5W0Z9 1/20 0.40
ZDHHC2 Q9UIJ5 1/20 0.40

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
SCHEMBL10577006 0.98 PPARA (0.52) PPARACA1CA2CA12CA7
SCHEMBL10570553 0.94 CA1 (0.52) PPARACA1CA2CA12CA7
SCHEMBL15367310 0.86 PPARA (0.49) PPARACA1CA2CA12CA7
SCHEMBL195896 0.82 GRIA1 (0.30)
SCHEMBL11794520 0.78 APP (0.35)
SCHEMBL694651 0.78 PPARA (0.60) PPARACA1CA2CA12CA7
SCHEMBL1703654 0.76 PPARA (0.64) PPARACA1CA2CA12CA7
SCHEMBL19687777 0.76
SCHEMBL7691833 0.76 PPARA (0.64) PPARACA1CA2CA12CA7
SCHEMBL860710 0.75 PPARA (0.52) PPARACA1CA2CA12CA7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3051946-B1 USE OF SUBSTITUTED DIHYDROOXINDOLYLSULFONAMIDES OR THEIR SALTS FOR INCREASING STRESS TOLERANCE IN PLANTS BAYER CROPSCIENCE AG (DE) 2017-11-29 EP claimed
EP-2422791-B1 ANTIVIRAL PHOSPHINATE COMPOUNDS GILEAD SCIENCES INC (US) 2014-12-17 EP claimed
EP-2649091-B1 IMMUNE RESTRICTED PEPTIDES WITH INCREASED EFFICACY STICHTING NL KANKER INST (NL) 2014-10-01 EP claimed
US-8674088-B2 Antiviral phosphinate compounds GILEAD SCIENCES, INC. (US) 2014-03-18 US claimed
US-20140004137-A1 IMMUNE RESTRICTED PEPTIDES WITH INCREASED EFFICACY STICHTING SANQUIN BLOEDVOORZIENING (NL) 2014-01-02 US claimed
EP-1907403-B1 ANTIVIRAL COMPOUNDS GILEAD SCIENCES INC (US) 2013-12-25 EP claimed
US-8586744-B2 Antiviral phosphinate compounds GILEAD SCIENCES, INC. (US) 2013-11-19 US claimed
EP-2649091-A1 IMMUNE RESTRICTED PEPTIDES WITH INCREASED EFFICACY Stichting Het Nederlands Kanker Instituut (NL) 2013-10-16 EP claimed
WO-2012076708-A1 IMMUNE RESTRICTED PEPTIDES WITH INCREASED EFFICACY STICHTING HET NEDERLANDS KANKER INSTITUUT (NL) 2012-06-14 WO claimed
WO-2012076059-A1 IMMUNE RESTRICTED PEPTIDES WITH INCREASED EFFICACY STICHTING HET NEDERLANDS KANKER INSTITUUT (NL) 2012-06-14 WO claimed
WO-2007011658-A1 ANTIVIRAL COMPOUNDS GILEAD SCIENCES, INC. (US) 2007-01-25 WO claimed
WO-2007009109-A2 ANTIVIRAL COMPOUNDS GILEAD SCIENCES, INC. (US) 2007-01-18 WO claimed
US-20060122123-A1 Antiviral compounds GILEAD SCIENCES, INC. 2006-06-08 US claimed
WO-2006020276-A2 ANTIVIRAL COMPOUNDS GILEAD SCIENCES, INC. (US) 2006-02-23 WO claimed
US-20050239808-A1 Active substances for the treatment, diagnosis and prophylaxis of diseases in which abnormal protein structures occur TRANSMIT GESELLSCHAFT FUR TECHNOLOGIETRANSFER MBH (DE) 2005-10-27 US claimed
EP-1503990-A1 ACTIVE SUBSTANCES FOR THE TREATMENT, DIAGNOSIS AND PROPHYLAXIS OF DISEASES IN WHICH ABNORMAL PROTEIN STRUCTURES OCCUR Transmit Gesellschaft für Technologietransfer mbH (DE) 2005-02-09 EP claimed
WO-2004056457-A2 METHOD FOR SEPARATING POLYMER SYSTEMS AND PORE-FREE POLYMER FILMS USED IN SAID METHOD PHILIPPS-UNIVERSITÄT MARBURG (DE) 2004-07-08 WO claimed
EP-1049691-B1 SUBSTITUTED 5-(2,2-DIFLUORO-1,3-BENZODIOXOL-5-YL) CYCLOPENTENOPYRIDINE DERIVATIVE BANYU PHARMA CO LTD (JP) 2004-02-18 EP claimed
WO-2003095429-A1 ACTIVE SUBSTANCES FOR THE TREATMENT, DIAGNOSIS AND PROPHYLAXIS OF DISEASES IN WHICH ABNORMAL PROTEIN STRUCTURES OCCUR TransMIT Gesellschaft für Technologietransfer mbH (DE) 2003-11-20 WO claimed
EP-0760658-B1 COMPOUNDS FOR INHIBITING OSTEOCLAST-MEDIATED BONE RESORPTION MERCK & CO INC (US) 2002-11-13 EP 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 (3 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-20140004137-A1 IMMUNE RESTRICTED PEPTIDES WITH INCREASED EFFICACY TAP2, HLA-DRB1, HLA-C PPARA 900/4885CA1 822/4885CA2 1327/4885
US-20050239808-A1 Active substances for the treatment, diagnosis and prophylaxis of diseases in which abnormal protein structures occur PRNP, APP, MAPT PPARA 2919/4885CA1 2260/4885CA2 4432/4885
US-20060122123-A1 Antiviral compounds EIF2AK2, MAVS, ITPA PPARA 1983/4885CA1 3835/4885CA2 2232/4885

“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.