SCHEMBL275076

SCHEMBL275076

O=C1N=Cc2cc(-c3cnc(NC4CCCCC4)c4nccn34)ccc21

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
FLT3 P36888 2/20 0.42
MAPK8 P45983 1/20 0.42
MAPKAPK5 Q8IW41 3/20 0.41
TTK P33981 10/20 0.40
ADORA3 P0DMS8 2/20 0.39
MAP3K7 O43318 2/20 0.38
TAB1 Q15750 2/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2C9 P11712 1/20 0.38

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
SCHEMBL275911 0.97 FLT3 (0.43) FLT3MAPK8MAPKAPK5TTKADORA3
SCHEMBL273763 0.83 MAPKAPK5 (0.41) MAPKAPK5TTKADORA3
SCHEMBL275077 0.83 MAPKAPK5 (0.59) FLT3MAPK8MAPKAPK5TTKADORA3
SCHEMBL279676 0.83 MAPKAPK5 (0.59) FLT3MAPK8MAPKAPK5TTKADORA3
SCHEMBL274498 0.82 MAPKAPK5 (0.42) MAPKAPK5TTKADORA3
SCHEMBL279474 0.82 MAPKAPK5 (0.60) FLT3MAPK8MAPKAPK5TTKADORA3
SCHEMBL275869 0.80 MAPKAPK5 (0.42) MAPKAPK5TTKADORA3
SCHEMBL275912 0.80 MAPKAPK5 (0.60) FLT3MAPK8MAPKAPK5TTKADORA3
SCHEMBL737845 0.79 MAPK8 (0.46) FLT3MAPK8MAPKAPK5TTKADORA3
SCHEMBL275491 0.77 MAPKAPK5 (0.43) FLT3MAPKAPK5TTK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8138193-B2 Fused pyrazine compounds useful for the treatment of degenerative and inflammatory diseases JANSSEN PHARMACEUTICA N.V. (BE) 2012-03-20 US claimed
US-20100240666-A1 FUSED PYRAZINE COMPOUNDS USEFUL FOR THE TREATMENT OF DEGENERATIVE AND INFLAMMATORY DISEASES ANDREWS MARTIN JAMES INGLIS 2010-09-23 US claimed
US-20090131446-A1 Fused pyrazine compounds useful for the treatment of degenerative and inflmmatory diseases GALAPAGOS, N.V. (BE) 2009-05-21 US claimed
US-8138193-B2 Fused pyrazine compounds useful for the treatment of degenerative and inflammatory diseases JANSSEN PHARMACEUTICA N.V. (BE) 2012-03-20 US disclosed
US-8133895-B2 Fused pyrazine compounds useful for the treatment of degenerative and inflammatory diseases JANSSEN PHARMACEUTICA N.V. (BE) 2012-03-13 US disclosed
US-20100240666-A1 FUSED PYRAZINE COMPOUNDS USEFUL FOR THE TREATMENT OF DEGENERATIVE AND INFLAMMATORY DISEASES ANDREWS MARTIN JAMES INGLIS 2010-09-23 US disclosed
US-20090131446-A1 Fused pyrazine compounds useful for the treatment of degenerative and inflmmatory diseases GALAPAGOS, N.V. (BE) 2009-05-21 US disclosed
WO-2008138843-A1 IMIDAZOPYRIDINES AND TRIAZOLOPYRIMIDINES USEFUL FOR THE TREATMENT OF JOINT DEGENERATIVE & INFLAMMATORY DISEASES GALAPAGOS N.V. (BE) 2008-11-20 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 (2 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-20090131446-A1 Fused pyrazine compounds useful for the treatment of degenerative and inflmmatory diseases NOD1, TNF, NOD2 FLT3 2549/4885MAPK8 4144/4885MAPKAPK5 1247/4885
US-20100240666-A1 FUSED PYRAZINE COMPOUNDS USEFUL FOR THE TREATMENT OF DEGENERATIVE AND INFLAMMATORY DISEASES RRP15, RARS2, RO60 FLT3 1384/4885MAPK8 3604/4885MAPKAPK5 1958/4885

“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.