SCHEMBL19032074

SCHEMBL19032074

Cc1[nH]c2c(C#N)cnn2c(=O)c1-c1ccc(Oc2ccc(OC(F)(F)F)cc2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM5A P29375 2/20 0.43
▸ NPBWR1 P48145 2/20 0.37
▸ MCHR1 Q99705 2/20 0.37
▸ SCN9A Q15858 1/20 0.37
▸ MDM2 Q00987 1/20 0.35
▸ DHODH Q02127 1/20 0.35
▸ RIPK3 Q9Y572 1/20 0.34
▸ PSD A5PKW4 1/20 0.34
▸ FNTA P49354 4/20 0.34
▸ FNTB P49356 4/20 0.34
▸ PGGT1B P53609 3/20 0.34
▸ LYN P07948 1/20 0.34
▸ RPS6KB1 P23443 1/20 0.34
▸ MARK3 P27448 1/20 0.34
▸ FLT3 P36888 1/20 0.34
▸ GSK3B P49841 1/20 0.34
▸ STK3 Q13188 1/20 0.34
▸ DYRK1A Q13627 1/20 0.34
▸ TAOK1 Q7L7X3 1/20 0.34
▸ AURKB Q96GD4 1/20 0.34

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
SCHEMBL16092479 0.79 MDM2 (0.52) KDM5AMDM2RPS6KB1MARK3FLT3
SCHEMBL16092329 0.78 KDM5A (0.55) KDM5ANPBWR1MCHR1FNTAFNTB
SCHEMBL22392719 0.77 NPBWR1 (0.40) KDM5ANPBWR1MCHR1SCN9APSD
SCHEMBL22392730 0.76 SCN5A (0.39) KDM5ANPBWR1MCHR1SCN9APSD
SCHEMBL19047331 0.74 PSD (0.39) KDM5ANPBWR1MCHR1PSDSLC2A1
SCHEMBL19047363 0.71 PSD (0.38) KDM5ANPBWR1MCHR1PSDSLC2A1
SCHEMBL22392723 0.70 PSD (0.42) PSDDYRK1ASCN5A
SCHEMBL16092315 0.69 KDM5A (0.57) KDM5ADHODHFNTAFNTBPGGT1B
SCHEMBL16050364 0.69 KDM5A (0.41) KDM5AMDM2POLBL3MBTL1
SCHEMBL20426058 0.69 KDM5A (0.42) KDM5ANPBWR1MDM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11964944-B2 Compounds and methods for treating, detecting, and identifying compounds to treat apicomplexan parasitic diseases THE UNIVERSITY OF CHICAGO (US) 2024-04-23 — — US claimed
US-20230140413-A1 Compounds and Methods for Treating, Detecting, and Identifying Compounds to Treat Apicomplexan Parasitic Diseases THE UNIVERSITY OF CHICAGO 2023-05-04 — — US claimed
US-20200283391-A1 Compounds and Methods for Treating, Detecting, and Identifying Compounds to Treat Apicomplexan Parasitic Diseases THE UNIVERSITY OF CHICAGO 2020-09-10 — — US claimed
US-11964944-B2 Compounds and methods for treating, detecting, and identifying compounds to treat apicomplexan parasitic diseases THE UNIVERSITY OF CHICAGO (US) 2024-04-23 — — US disclosed
US-20230181564-A1 Potent Tetrahydroquinolone Eliminates Apicomplexan Parasites THE UNIVERSITY OF SHEFFIELD (GB) 2023-06-15 — — US disclosed
US-20230140413-A1 Compounds and Methods for Treating, Detecting, and Identifying Compounds to Treat Apicomplexan Parasitic Diseases THE UNIVERSITY OF CHICAGO 2023-05-04 — — US disclosed
US-20230140413-A1 Compounds and Methods for Treating, Detecting, and Identifying Compounds to Treat Apicomplexan Parasitic Diseases THE UNIVERSITY OF CHICAGO 2023-05-04 — — US disclosed
US-20230140413-A1 Compounds and Methods for Treating, Detecting, and Identifying Compounds to Treat Apicomplexan Parasitic Diseases THE UNIVERSITY OF CHICAGO 2023-05-04 — — US disclosed
US-11414385-B2 Compounds and methods for treating, detecting, and identifying compounds to treat apicomplexan parasitic diseases THE UNIVERSITY OF CHICAGO 2022-08-16 — — US disclosed
US-20200283391-A1 Compounds and Methods for Treating, Detecting, and Identifying Compounds to Treat Apicomplexan Parasitic Diseases THE UNIVERSITY OF CHICAGO 2020-09-10 — — US disclosed
US-20200283391-A1 Compounds and Methods for Treating, Detecting, and Identifying Compounds to Treat Apicomplexan Parasitic Diseases THE UNIVERSITY OF CHICAGO 2020-09-10 — — US disclosed
EP-3394032-A1 COMPOUNDS AND METHODS FOR TREATING, DETECTING, AND IDENTIFYING COMPOUNDS TO TREAT APICOMPLEXAN PARASITIC DISEASES The University of Chicago (US) 2018-10-31 — — EP disclosed
WO-2017112678-A1 COMPOUNDS AND METHODS FOR TREATING, DETECTING, AND IDENTIFYING COMPOUNDS TO TREAT APICOMPLEXAN PARASITIC DISEASES MCLEOD RIMA (US) 2017-06-29 — — WO disclosed
WO-2017112678-A1 COMPOUNDS AND METHODS FOR TREATING, DETECTING, AND IDENTIFYING COMPOUNDS TO TREAT APICOMPLEXAN PARASITIC DISEASES MCLEOD RIMA (US) 2017-06-29 — — 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 (5 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-20200283391-A1 Compounds and Methods for Treating, Detecting, and Identifying Compounds to Treat Apicomplexan Parasitic Diseases TUBB1, MYADM, TUBB KDM5A 2952/4885NPBWR1 3420/4885MCHR1 2039/4885
US-11964944-B2 Compounds and methods for treating, detecting, and identifying compounds to treat apicomplexan parasitic diseases TUBB1, MYADM, TUBB KDM5A 2810/4885NPBWR1 3464/4885MCHR1 1923/4885
US-20230140413-A1 Compounds and Methods for Treating, Detecting, and Identifying Compounds to Treat Apicomplexan Parasitic Diseases TUBB1, MYADM, TUBB KDM5A 2810/4885NPBWR1 3464/4885MCHR1 1923/4885
US-11414385-B2 Compounds and methods for treating, detecting, and identifying compounds to treat apicomplexan parasitic diseases TUBB1, MYADM, TUBB KDM5A 2952/4885NPBWR1 3420/4885MCHR1 2039/4885
US-20230181564-A1 Potent Tetrahydroquinolone Eliminates Apicomplexan Parasites CYP11B2, CYP11B1, COX5B KDM5A 1781/4885NPBWR1 4548/4885MCHR1 4058/4885

“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.

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