SCHEMBL16014459

SCHEMBL16014459

Nc1nc(Nc2ccc(I)cc2)n[nH]1

nearest known ligand 0.70

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.70
GFER P55789 2/20 0.70
MEN1 O00255 1/20 0.70
KMT2A Q03164 1/20 0.70
JAK2 O60674 1/20 0.64
MAPT P10636 1/20 0.54

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
SCHEMBL31271749 0.82 GAA (0.70) GAAGFERMEN1KMT2AJAK2
SCHEMBL31272020 0.82 GAA (1.00) GAAGFERMEN1KMT2AJAK2
SCHEMBL12845739 0.82 GAA (0.70) GAAGFERMEN1KMT2AJAK2
SCHEMBL18856549 0.82 GAA (0.70) GAAGFERMEN1KMT2AJAK2
SCHEMBL6744037 0.81 GAA (1.00) GAAGFERMEN1KMT2AJAK2
SCHEMBL17393904 0.81 GAA (0.68) GAAGFERMEN1KMT2AJAK2
SCHEMBL17402829 0.79 GAA (0.81) GAAGFERMEN1KMT2AJAK2
SCHEMBL18856733 0.78 JAK2 (1.00) GAAGFERMEN1KMT2AJAK2
SCHEMBL31271903 0.78 GAA (0.64) GAAGFERMEN1KMT2AJAK2
SCHEMBL15545518 0.78 GAA (0.64) GAAGFERMEN1KMT2AJAK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4132652-A1 AXL INHIBITORS FOR ANTIVIRAL THERAPY BerGenBio ASA (NO) 2023-02-15 EP disclosed
EP-2964635-B1 ANTIVIRAL COMPOUNDS HOFFMANN LA ROCHE (CH) 2018-05-02 EP disclosed
US-9693997-B2 Antiviral compounds HOFFMANN-LA ROCHE INC. (US) 2017-07-04 US disclosed
US-9693997-B2 Antiviral compounds HOFFMANN-LA ROCHE INC. (US) 2017-07-04 US disclosed
US-9693997-B2 Antiviral compounds HOFFMANN-LA ROCHE INC. (US) 2017-07-04 US disclosed
CN-105102449-B Antiviral compound 豪夫迈·罗氏有限公司 2017-06-13 CN disclosed
EP-2964635-A1 ANTIVIRAL COMPOUNDS F. Hoffmann-La Roche AG (CH) 2016-01-13 EP disclosed
US-20160000760-A1 ANTIVIRAL COMPOUNDS HOFFMANN-LA ROCHE INC. (US) 2016-01-07 US disclosed
US-20160000760-A1 ANTIVIRAL COMPOUNDS HOFFMANN-LA ROCHE INC. (US) 2016-01-07 US disclosed
US-20160000760-A1 ANTIVIRAL COMPOUNDS HOFFMANN-LA ROCHE INC. (US) 2016-01-07 US disclosed
CN-105102449-A Antiviral compounds HOFFMANN LA ROCHE 2015-11-25 CN disclosed
WO-2014135495-A1 ANTIVIRAL COMPOUNDS F. HOFFMANN-LA ROCHE AG (CH) 2014-09-12 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 (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-20160000760-A1 ANTIVIRAL COMPOUNDS HAVCR2, EIF2AK2, MAVS GAA 88/4885GFER 3631/4885MEN1 4686/4885

“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.