SCHEMBL2143206

SCHEMBL2143206

CNC(=O)c1ccc(-c2ccc([C@](C)(F)CNS(=O)(=O)C(C)C)cc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GRIA4 P48058 9/20 0.44
PLK1 P53350 1/20 0.40
EPHX2 P34913 2/20 0.39
NR1H4 Q96RI1 2/20 0.39
HDAC6 Q9UBN7 2/20 0.39
HDAC4 P56524 1/20 0.39
CA2 P00918 1/20 0.38
PDK2 Q15119 1/20 0.38
RORC P51449 1/20 0.37
MKNK1 Q9BUB5 1/20 0.37
MKNK2 Q9HBH9 1/20 0.37
HDAC2 Q92769 1/20 0.36
HDAC8 Q9BY41 1/20 0.36
PPARA Q07869 1/20 0.36
GRIA2 P42262 1/20 0.36
CA12 O43570 1/20 0.36
CA1 P00915 1/20 0.36
CA9 Q16790 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
SCHEMBL14394695 1.00 GRIA4 (0.44) GRIA4PLK1EPHX2NR1H4HDAC6
SCHEMBL2461910 1.00 GRIA4 (0.44) GRIA4PLK1EPHX2NR1H4HDAC6
SCHEMBL5186058 0.89 GRIA4 (0.57) GRIA4EPHX2NR1H4
SCHEMBL3711628 0.88 GRIA4 (0.48) GRIA4CA2GRIA2CA1
SCHEMBL13255710 0.88 GRIA4 (0.48) GRIA4CA2GRIA2CA1
SCHEMBL5187397 0.88 HDAC4 (0.43) GRIA4EPHX2NR1H4HDAC6HDAC4
SCHEMBL5186190 0.88 GRIA4 (0.44) GRIA4EPHX2NR1H4CA2RORC
SCHEMBL5187928 0.85 GRIA4 (0.43) GRIA4EPHX2NR1H4HDAC4PDK2
SCHEMBL8294927 0.84 GRIA4 (0.41) GRIA4EPHX2NR1H4GRIA2
SCHEMBL6561639 0.84 GRIA4 (0.51) GRIA4EPHX2NR1H4CA2CA12

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 15 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3316890-B1 NOVEL BREATHING CONTROL MODULATING COMPOUNDS, AND METHODS OF MAKING AND USING SAME NEURAD LTD (IL) 2023-09-06 EP disclosed
US-10294228-B2 Breathing control modulating compounds, and methods of making and using same NEURAD LTD. (IL) 2019-05-21 US disclosed
US-20180141953-A1 Novel Breathing Control Modulating Compounds, and Methods of Making and Using Same NEURAD LTD. (IL) 2018-05-24 US disclosed
US-9643971-B2 Breathing control modulating compounds, and methods of using same GALLEON PHARMACEUTICALS, INC. (US) 2017-05-09 US disclosed
US-20160256463-A1 NOVEL COMPOUNDS AS RESPIRATORY STIMULANTS FOR TREATMENT OF BREATHING CONTROL DISORDERS OR DISEASES GALLEON PHARMACEUTICALS INC (US) 2016-09-08 US disclosed
US-9351972-B2 Compounds as respiratory stimulants for treatment of breathing control disorders or diseases GALLEON PHARMACEUTICALS, INC. (US) 2016-05-31 US disclosed
US-20150374706-A1 NOVEL COMPOUNDS AND COMPOSITIONS FOR TREATMENT OF BREATHING CONTROL DISORDERS OR DISEASES GALLEON PHARMACEUTICALS, INC. 2015-12-31 US disclosed
US-9162992-B2 Compounds and compositions for treatment of breathing control disorders or diseases GALLEON PHARMACEUTICALS, INC. (US) 2015-10-20 US disclosed
US-20150291597-A1 NOVEL ORALLY BIOAVAILABLE BREATHING CONTROL MODULATING COMPOUNDS, AND METHODS OF USING SAME GALLEON PHARMACEUTICALS, INC. 2015-10-15 US disclosed
US-20150246061-A1 VITAMIN D ANALOGUES FOR THE TREATMENT OF A NEUROLOGICAL DISORDER CELUS PHARMACEUTICALS, INC. 2015-09-03 US disclosed
US-20140371224-A1 NOVEL COMPOUNDS AND COMPOSITIONS FOR TREATMENT OF BREATHING CONTROL DISORDERS OR DISEASES GALLEON PHARMACEUTICALS, INC. 2014-12-18 US disclosed
US-20120295911-A1 Novel Compounds and Compositions for Treatment of Breathing Control Disorders or Diseases GALLEON PHARMACEUTICALS, INC. 2012-11-22 US disclosed
US-20120270848-A1 Novel Compositions and Therapeutic Methods Using Same GALLEON PHARMACEUTICALS, INC. 2012-10-25 US disclosed
US-20120142647-A1 Novel Compounds as Respiratory Stimulants for Treatment of Breathing Control Disorders or Diseases GALLEON PHARMACEUTICALS, INC. 2012-06-07 US disclosed
US-20120101073-A1 Novel Method For Treating Breathing Disorders or Diseases GALLEON PHARMACEUTICAL, INC. 2012-04-26 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 (11 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-20120101073-A1 Novel Method For Treating Breathing Disorders or Diseases ACER2, ASAH2, PDE12 GRIA4 1981/4885PLK1 4683/4885EPHX2 1652/4885
US-20120142647-A1 Novel Compounds as Respiratory Stimulants for Treatment of Breathing Control Disorders or Diseases MTNR1B, CHRM3, ADRA2C GRIA4 613/4885PLK1 1512/4885EPHX2 880/4885
US-20120295911-A1 Novel Compounds and Compositions for Treatment of Breathing Control Disorders or Diseases PER2, SMPD4, NDUFB5 GRIA4 2967/4885PLK1 1993/4885EPHX2 547/4885
US-20150291597-A1 NOVEL ORALLY BIOAVAILABLE BREATHING CONTROL MODULATING COMPOUNDS, AND METHODS OF USING SAME MTNR1B, TNNC1, PER2 GRIA4 2683/4885PLK1 3482/4885EPHX2 763/4885
US-20180141953-A1 Novel Breathing Control Modulating Compounds, and Methods of Making and Using Same MTNR1B, CHRM3, PER2 GRIA4 1578/4885PLK1 2428/4885EPHX2 903/4885
US-20140371224-A1 NOVEL COMPOUNDS AND COMPOSITIONS FOR TREATMENT OF BREATHING CONTROL DISORDERS OR DISEASES PER2, MTNR1B, NDUFB5 GRIA4 2074/4885PLK1 1631/4885EPHX2 846/4885
US-20160256463-A1 NOVEL COMPOUNDS AS RESPIRATORY STIMULANTS FOR TREATMENT OF BREATHING CONTROL DISORDERS OR DISEASES P2RX5, HRH2, ADRA2C GRIA4 705/4885PLK1 845/4885EPHX2 652/4885
US-20150374706-A1 NOVEL COMPOUNDS AND COMPOSITIONS FOR TREATMENT OF BREATHING CONTROL DISORDERS OR DISEASES PER2, SMPD4, NDUFB5 GRIA4 2967/4885PLK1 1993/4885EPHX2 547/4885
US-10294228-B2 Breathing control modulating compounds, and methods of making and using same MTNR1B, PDE3A, CHRM3 GRIA4 1697/4885PLK1 2916/4885EPHX2 889/4885
US-20150246061-A1 VITAMIN D ANALOGUES FOR THE TREATMENT OF A NEUROLOGICAL DISORDER VDR, CYP24A1, CYP2R1 GRIA4 319/4885PLK1 1924/4885EPHX2 1040/4885
US-20120270848-A1 Novel Compositions and Therapeutic Methods Using Same OPRM1, OPRK1, OPRD1 GRIA4 178/4885PLK1 4060/4885EPHX2 715/4885

“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.