SCHEMBL2178599

SCHEMBL2178599

COc1ccc(-c2cnc3c(NCc4cccc(S(N)(=O)=O)c4)nccn23)cc1

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TTK P33981 6/20 0.48
PI4KB Q9UBF8 1/20 0.47
ADORA3 P0DMS8 2/20 0.46
TP53 P04637 2/20 0.44
MAPT P10636 2/20 0.44
POLB P06746 1/20 0.44
ZAP70 P43403 2/20 0.43
GAA P10253 2/20 0.42
FYN P06241 1/20 0.41
THRB P10828 1/20 0.41
KARS1 Q15046 1/20 0.41
NTRK1 P04629 1/20 0.40
NTRK3 Q16288 1/20 0.40
NTRK2 Q16620 1/20 0.40

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
SCHEMBL12409228 0.89 CA1 (0.52) TTKTP53MAPTZAP70GAA
SCHEMBL2180707 0.88 TTK (0.52) TTKPI4KBADORA3NTRK1NTRK3
SCHEMBL12409263 0.88 PI4KB (0.51) TTKPI4KBADORA3FYN
SCHEMBL13937882 0.84 TTK (0.52) TTKADORA3TP53MAPTPOLB
SCHEMBL12409270 0.84 FYN (0.58) TTKADORA3TP53MAPTPOLB
SCHEMBL12409251 0.84 ZAP70 (0.50) TTKADORA3TP53MAPTZAP70
SCHEMBL12409250 0.83 ZAP70 (0.51) TTKADORA3TP53MAPTZAP70
SCHEMBL14664246 0.83 PI4KB (0.53) TTKPI4KBADORA3NTRK1NTRK3
SCHEMBL12409266 0.83 PI4KB (0.63) TTKPI4KBADORA3NTRK1NTRK3
SCHEMBL12409445 0.81 PI4KB (0.60) TTKPI4KBADORA3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2567960-A2 Imidazo[1,2-a]pyrazine compounds for treatment of viral infections such as hepatitis Biofocus DPI Limited (GB) 2013-03-13 EP disclosed
EP-2193131-B1 IMIDAZO[1,2-A]PYRAZINE COMPOUNDS FOR TREATMENT OF VIRAL INFECTIONS SUCH AS HEPATITIS BIOFOCUS DPI LTD (GB) 2013-01-30 EP disclosed
US-8362018-B2 Substituted imidazo[1,2-a]pyrazine compounds useful for the treatment of viral infections BIOFOCUS DPI, LTD. (GB) 2013-01-29 US disclosed
US-8362018-B2 Substituted imidazo[1,2-a]pyrazine compounds useful for the treatment of viral infections BIOFOCUS DPI, LTD. (GB) 2013-01-29 US disclosed
US-8362018-B2 Substituted imidazo[1,2-a]pyrazine compounds useful for the treatment of viral infections BIOFOCUS DPI, LTD. (GB) 2013-01-29 US disclosed
US-20110166147-A1 IMIDAZOPYRAZINE COMPOUNDS BIOFOCUS DPI, LTD. (GB) 2011-07-07 US disclosed
US-20110166147-A1 IMIDAZOPYRAZINE COMPOUNDS BIOFOCUS DPI, LTD. (GB) 2011-07-07 US disclosed
EP-2193131-A2 IMIDAZO[1,2-A]PYRAZINE COMPOUNDS FOR TREATMENT OF VIRAL INFECTIONS SUCH AS HEPATITIS Biofocus DPI Limited (GB) 2010-06-09 EP disclosed
WO-2009024585-A2 IMIDAZO [1,2-A] PYRAZINE COMPOUNDS FOR TREATMENT OF VIRAL INFECTIONS SUCH AS HEPATITIS BIOFOCUS DPI LIMITED (GB) 2009-02-26 WO disclosed
WO-2009024585-A2 IMIDAZO [1,2-A] PYRAZINE COMPOUNDS FOR TREATMENT OF VIRAL INFECTIONS SUCH AS HEPATITIS BIOFOCUS DPI LIMITED (GB) 2009-02-26 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-20110166147-A1 IMIDAZOPYRAZINE COMPOUNDS CYP3A5, HAVCR2, CYP3A43 TTK 3239/4885PI4KB 2534/4885ADORA3 4222/4885

“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.