SCHEMBL2217060

SCHEMBL2217060

O=C1NCc2cc(-c3cnc(Nc4ccc(F)cc4)c4ncnn34)ccc21

nearest known ligand 0.76

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPKAPK5 Q8IW41 5/20 0.76
MKNK1 Q9BUB5 5/20 0.43
F9 P00740 1/20 0.42
MKNK2 Q9HBH9 3/20 0.40
PIK3CD O00329 1/20 0.40
GRM5 P41594 1/20 0.39
PRF1 P14222 1/20 0.39
DAPK3 O43293 1/20 0.39
NTRK1 P04629 1/20 0.39
PIM1 P11309 1/20 0.39
FLT3 P36888 1/20 0.39
GSK3B P49841 1/20 0.39
ROCK1 Q13464 1/20 0.39
CLK4 Q9HAZ1 1/20 0.39
TBK1 Q9UHD2 1/20 0.38
PRKCI P41743 1/20 0.38
JAK2 O60674 1/20 0.37
TYK2 P29597 1/20 0.37

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
SCHEMBL12443697 0.88 MAPKAPK5 (0.63) MAPKAPK5MKNK1F9MKNK2PIK3CD
SCHEMBL12443284 0.87 MAPKAPK5 (0.89) MAPKAPK5MKNK1F9MKNK2PIK3CD
SCHEMBL1477011 0.87 MAPKAPK5 (1.00) MAPKAPK5PIK3CDTBK1
SCHEMBL1475944 0.86 MAPKAPK5 (0.75) MAPKAPK5MKNK1F9MKNK2PIK3CD
SCHEMBL12443280 0.86 MAPKAPK5 (0.72) MAPKAPK5MKNK1F9MKNK2PIK3CD
SCHEMBL12443293 0.85 MAPKAPK5 (0.72) MAPKAPK5MKNK1F9MKNK2PIK3CD
SCHEMBL2217522 0.84 MAPKAPK5 (0.83) MAPKAPK5MKNK1F9PIK3CDFLT3
SCHEMBL1477098 0.84 MAPKAPK5 (0.83) MAPKAPK5MKNK1F9MKNK2PIK3CD
SCHEMBL12443700 0.84 MAPKAPK5 (0.65) MAPKAPK5MKNK1F9PIK3CD
SCHEMBL1475392 0.83 MAPKAPK5 (0.81) MAPKAPK5MKNK1F9MKNK2PIK3CD

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
US-20110178067-A1 TRIAZOLOPYRAZINE COMPOUNDS USEFUL FOR THE TREATMENT OF DEGENERATIVE AND INFLAMMATORY DISEASES ANDREWS MARTIN JAMES INGLIS 2011-07-21 US claimed
EP-2029602-B1 TRIAZOLOPYRAZINE COMPOUNDS USEFUL FOR THE TREATMENT OF DEGENERATIVE & INFLAMMATORY DISEASES GALAPAGOS NV (BE) 2010-04-21 EP claimed
US-20080090818-A1 Triazolopyrazine compounds useful for the treatment of degenerative & inflammatory diseases GALAPAGOS NV (BE) 2008-04-17 US claimed
US-20110178067-A1 TRIAZOLOPYRAZINE COMPOUNDS USEFUL FOR THE TREATMENT OF DEGENERATIVE AND INFLAMMATORY DISEASES ANDREWS MARTIN JAMES INGLIS 2011-07-21 US disclosed
US-20110178067-A1 TRIAZOLOPYRAZINE COMPOUNDS USEFUL FOR THE TREATMENT OF DEGENERATIVE AND INFLAMMATORY DISEASES ANDREWS MARTIN JAMES INGLIS 2011-07-21 US disclosed
US-7915256-B2 Triazolopyrazine compounds useful for the treatment of degenerative and inflammatory diseases GALAPAGOS NV (BE) 2011-03-29 US disclosed
US-7915256-B2 Triazolopyrazine compounds useful for the treatment of degenerative and inflammatory diseases GALAPAGOS NV (BE) 2011-03-29 US disclosed
US-20100298300-A1 TRIAZOLOPYRAZINE COMPOUNDS USEFUL FOR THE TREATMENT OF DEGENERATIVE & INFLAMMATORY DISEASES ANDREWS MARTIN JAMES INGLIS 2010-11-25 US disclosed
US-7501411-B2 Triazolopyrazine compounds useful for the treatment of degenerative and inflammatory diseases GALAPAGOS, NV (BE) 2009-03-10 US disclosed
US-20080090818-A1 Triazolopyrazine compounds useful for the treatment of degenerative & inflammatory diseases GALAPAGOS NV (BE) 2008-04-17 US 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 (3 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-20110178067-A1 TRIAZOLOPYRAZINE COMPOUNDS USEFUL FOR THE TREATMENT OF DEGENERATIVE AND INFLAMMATORY DISEASES PTGES, IL1B, PTGER1 MAPKAPK5 5/4885MKNK1 258/4885F9 4049/4885
US-20100298300-A1 TRIAZOLOPYRAZINE COMPOUNDS USEFUL FOR THE TREATMENT OF DEGENERATIVE & INFLAMMATORY DISEASES P2RX5, P2RX3, IL1B MAPKAPK5 18/4885MKNK1 279/4885F9 4338/4885
US-20080090818-A1 Triazolopyrazine compounds useful for the treatment of degenerative & inflammatory diseases P2RX5, P2RX3, IL1B MAPKAPK5 18/4885MKNK1 279/4885F9 4338/4885

“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.