SCHEMBL83484

SCHEMBL83484

CCCCc1ccc(C(=O)CCC)cc1

nearest known ligand 0.68

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
THRA P10827 10/20 0.68
THRB P10828 10/20 0.68
L3MBTL1 Q9Y468 1/20 0.61
RARB P10826 1/20 0.61
PLK1 P53350 1/20 0.61
HSD17B3 P37058 3/20 0.60
HAO1 Q9UJM8 1/20 0.57
ALDH1A1 P00352 1/20 0.56
HPGD P15428 1/20 0.56
HSD17B10 Q99714 1/20 0.56
HTR7 P34969 1/20 0.55

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
SCHEMBL30089476 0.94 THRA (0.70) THRATHRBL3MBTL1RARBPLK1
SCHEMBL15960542 0.93 THRA (0.79) THRATHRBRARBHAO1ALDH1A1
SCHEMBL12600892 0.87 NPC1 (0.66) THRATHRBL3MBTL1HSD17B3HAO1
SCHEMBL3234253 0.87 THRA (0.66) THRATHRBL3MBTL1RARBPLK1
SCHEMBL7813104 0.87 L3MBTL1 (0.81) THRATHRBL3MBTL1RARBPLK1
SCHEMBL27352122 0.87 THRA (0.62) THRATHRBL3MBTL1RARBPLK1
SCHEMBL7633932 0.86 PLK1 (0.68) THRATHRBRARBPLK1HAO1
SCHEMBL10031544 0.86 THRA (0.64) THRATHRBRARBPLK1HAO1
SCHEMBL28013341 0.86 THRA (0.64) THRATHRBL3MBTL1RARBPLK1
SCHEMBL8971794 0.86 THRA (0.60) THRATHRBL3MBTL1RARBHSD17B3

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
US-9175061-B2 Protein conjugates and methods for their preparation NOVO NORDISK HEALTH CARE AG (CH) 2015-11-03 US disclosed
US-20120142781-A1 Antagonists of the Magnesium Binding Defect as Therapeutic Agents and Methods for Treatment of Abnormal Physiological States MAGNESIUM DIAGNOSTICS INC. (US) 2012-06-07 US disclosed
US-8129545-B2 Antagonists of the magnesium binding defect as therapeutic agents and methods for treatment of abnormal physiological states MAGNESIUM DIAGNOSTICS, INC. (US) 2012-03-06 US disclosed
US-8129545-B2 Antagonists of the magnesium binding defect as therapeutic agents and methods for treatment of abnormal physiological states MAGNESIUM DIAGNOSTICS, INC. (US) 2012-03-06 US disclosed
US-20110281923-A1 ANTAGONISTS OF THE MAGNESIUM BINDING DEFECT AS THERAPEUTIC AGENTS AND METHODS FOR TREATMENT OF ABNORMAL PHYSIOLOGICAL STATES MAGNESIUM DIAGNOSTICS INC. (US) 2011-11-17 US disclosed
US-20110281923-A1 ANTAGONISTS OF THE MAGNESIUM BINDING DEFECT AS THERAPEUTIC AGENTS AND METHODS FOR TREATMENT OF ABNORMAL PHYSIOLOGICAL STATES MAGNESIUM DIAGNOSTICS INC. (US) 2011-11-17 US disclosed
US-7982048-B2 Antagonists of the magnesium binding defect as therapeutic agents and methods for treatment of abnormal physiological states MAGNESIUM DIAGNOSTICS, INC. (US) 2011-07-19 US disclosed
US-7982048-B2 Antagonists of the magnesium binding defect as therapeutic agents and methods for treatment of abnormal physiological states MAGNESIUM DIAGNOSTICS, INC. (US) 2011-07-19 US disclosed
US-20110144017-A1 Protein conjugates and methods for their preparation NOVO NORDISK HEALTH CARE AG (CH) 2011-06-16 US disclosed
US-20110021633-A1 Antagonists of the Magnesium Binding Defect as Therapeutic Agents and Methods for Treatment of Abnormal Physiological States MAGNESIUM DIAGNOSTICS, INC. 2011-01-27 US disclosed
US-7132537-B2 Antagonists of the magnesium binding defect as therapeutic agents and methods for treatment of abnormal physiological states MAGNESIUM DIAGNOSTICS, INC. (US) 2006-11-07 US disclosed
US-7041829-B2 Antagonists of the magnesium binding defect as therapeutic agents and methods for treatment of abnormal physiological states MAGNESIUM DIAGNOSTICS, INC. (US) 2006-05-09 US disclosed
EP-1355638-B1 ANTAGONISTS OF THE MAGNESIUM BINDING DEFECT AS THERAPEUTIC AGENTS AND METHODS FOR TREATMENT OF ABNORMAL PHYSIOLOGICAL STATES MAGNESIUM DIAGNOSTICS INC (US) 2006-05-03 EP disclosed
US-20060069259-A1 Antagonists of the magnesium binding defect as therapeutic agents and methods for treatment of abnormal physiological states MAGNESIUM DIAGNOSTICS, INC. 2006-03-30 US disclosed
US-20050096279-A1 Antagonists of the magnesium binding defect as therapeutic agents and methods for treatment of abnormal physiological states MAGNESIUM DIAGNOSTICS, INC. 2005-05-05 US disclosed
US-6664420-B2 For therapy of hypertension, type 2 insulin-resistant diabetes mellitus, ecalmpsia and preeclampsia MAGNESIUM DIAGNOSTICS, INC. 2003-12-16 US disclosed
EP-1355638-A2 ANTAGONISTS OF THE MAGNESIUM BINDING DEFECT AS THERAPEUTIC AGENTS AND METHODS FOR TREATMENT OF ABNORMAL PHYSIOLOGICAL STATES Magnesium Diagnostics, Inc. (US) 2003-10-29 EP disclosed
US-20030040625-A1 Antagonists of the magnesium binding defect as therapeutic agents and methods for treatment of abnormal physiological states MAGNESIUM DIAGNOSTICS, INC. 2003-02-27 US disclosed
US-6455734-B1 ADMINISTERING PHENYLGLYCINAMIDE(N-2,4-DIAMYLPENTANOIC ACID AMIDE) AS HYPOTENSIVE AGENTS FOR PROPHYLAXIS OF INSULIN RESISTANCE, ECLAMPSIA AND SENSITIVITY TO BLOOD METAL CONCENTRATIONS MAGNESIUM DIAGNOSTICS, INC. 2002-09-24 US disclosed
WO-2002011714-A2 ANTAGONISTS OF THE MAGNESIUM BINDING DEFECT AS THERAPEUTIC AGENTS AND METHODS FOR TREATMENT OF ABNORMAL PHYSIOLOGICAL STATES MAGNESIUM DIAGNOSTICS, INC. (US) 2002-02-14 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 (7 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-20030040625-A1 Antagonists of the magnesium binding defect as therapeutic agents and methods for treatment of abnormal physiological states ECE1, PLPBP, ECE2 THRA 1040/4885THRB 350/4885L3MBTL1 288/4885
US-20120142781-A1 Antagonists of the Magnesium Binding Defect as Therapeutic Agents and Methods for Treatment of Abnormal Physiological States PLPBP, ECE1, MCU THRA 1022/4885THRB 366/4885L3MBTL1 315/4885
US-20110021633-A1 Antagonists of the Magnesium Binding Defect as Therapeutic Agents and Methods for Treatment of Abnormal Physiological States PLPBP, ECE1, MCU THRA 1022/4885THRB 366/4885L3MBTL1 315/4885
US-20060069259-A1 Antagonists of the magnesium binding defect as therapeutic agents and methods for treatment of abnormal physiological states ECE1, PLPBP, ECE2 THRA 1040/4885THRB 350/4885L3MBTL1 288/4885
US-20050096279-A1 Antagonists of the magnesium binding defect as therapeutic agents and methods for treatment of abnormal physiological states PLPBP, ECE1, MCU THRA 1022/4885THRB 366/4885L3MBTL1 315/4885
US-20110281923-A1 ANTAGONISTS OF THE MAGNESIUM BINDING DEFECT AS THERAPEUTIC AGENTS AND METHODS FOR TREATMENT OF ABNORMAL PHYSIOLOGICAL STATES PLPBP, ECE1, MCU THRA 1022/4885THRB 366/4885L3MBTL1 315/4885
US-20110144017-A1 Protein conjugates and methods for their preparation PTMS, DNPEP, ANPEP THRA 1922/4885THRB 3163/4885L3MBTL1 1745/4885

“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.