SCHEMBL3679773

SCHEMBL3679773

CNC(=O)c1noc(C)n1

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PLK1 P53350 1/20 0.53
POLB P06746 1/20 0.36
RECQL P46063 1/20 0.36
HDAC6 Q9UBN7 4/20 0.36
HDAC1 Q13547 3/20 0.36
HDAC8 Q9BY41 2/20 0.36
BMP1 P13497 1/20 0.35
MAPT P10636 1/20 0.35
SMPD1 P17405 1/20 0.35
KDM4E B2RXH2 2/20 0.34
HDAC4 P56524 1/20 0.34
BACE1 P56817 2/20 0.34
DPP4 P27487 3/20 0.33
GAA P10253 2/20 0.33
DPP8 Q6V1X1 1/20 0.33
DPP7 Q9UHL4 1/20 0.33
TSHR P16473 1/20 0.33
SMYD3 Q9H7B4 1/20 0.33
ALDH1A1 P00352 1/20 0.33

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
SCHEMBL18737649 0.83 HDAC1 (0.51) PLK1POLBRECQLHDAC6HDAC1
SCHEMBL23529915 0.82 GAA (0.47) PLK1POLBRECQLHDAC6HDAC1
SCHEMBL21888991 0.79 AOC3 (0.39) PLK1POLBRECQLHDAC6HDAC1
SCHEMBL13631408 0.79 GAA (0.42) PLK1POLBRECQLHDAC6MAPT
SCHEMBL13631411 0.79 MAPT (0.44) PLK1POLBRECQLBMP1MAPT
SCHEMBL11826581 0.77 ALDH1A1 (0.51) PLK1POLBRECQLMAPTKDM4E
SCHEMBL13631412 0.76 SMYD3 (0.56) KDM4EHDAC4TSHRSMYD3ALDH1A1
SCHEMBL1760325 0.76
SCHEMBL1828616 0.76
SCHEMBL17664669 0.75 HDAC6 (0.41) PLK1HDAC6HDAC1HDAC8BMP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230011118-A1 INHIBITORS OF APOL1 AND METHODS OF USING SAME VERTEX PHARMACEUTICALS INCORPORATED 2023-01-12 US disclosed
EP-3564239-A1 ARYL HYDROCARBON RECEPTOR MODULATOR Shenzhen Immunova Pharmaceutical Co., Ltd. (CN) 2019-11-06 EP disclosed
EP-2178537-A1 BETA CARBOLINE DERIVATIVES AS ANTIDIABETIC COMPOUNDS Merck Sharp & Dohme Corp. (US) 2010-04-28 EP disclosed
US-7622464-B2 Morpholinyl-urea derivatives for use in the treatment of inflammatory diseases GLAXO GROUP LIMITED (GB) 2009-11-24 US disclosed
US-7622464-B2 Morpholinyl-urea derivatives for use in the treatment of inflammatory diseases GLAXO GROUP LIMITED (GB) 2009-11-24 US disclosed
WO-2009011836-A1 BETA CARBOLINE DERIVATIVES AS ANTIDIABETIC COMPOUNDS MERCK & CO., INC. (US) 2009-01-22 WO disclosed
EP-1487828-B1 MORPHOLINYL-UREA DERIVATIVES FOR USE OF THE TREATMENT OF INFLAMATORY DISEASES GLAXO GROUP LTD (GB) 2008-11-05 EP 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 (1 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-20230011118-A1 INHIBITORS OF APOL1 AND METHODS OF USING SAME APOL1, APOB, SAAL1 PLK1 2723/4885POLB 3886/4885RECQL 1591/4885

“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.