SCHEMBL2389258

SCHEMBL2389258

CC(C)(C)N1C[C@@H]2C[C@H]1CN2c1ccc(Nc2ncc(-c3cc(C(N)=O)n[nH]3)n3ncnc23)cc1

nearest known ligand 0.40

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MAPKAPK5 Q8IW41 11/20 0.40
SYK P43405 1/20 0.34
BTK Q06187 1/20 0.32

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
SCHEMBL2387713 0.89 SYK (0.43) MAPKAPK5SYKBTK
SCHEMBL2390549 0.83 MAPKAPK5 (0.48) MAPKAPK5SYKBTK
SCHEMBL2390918 0.83 MAPKAPK5 (0.48) MAPKAPK5SYKBTK
SCHEMBL2391989 0.80 BTK (0.37) MAPKAPK5SYKBTK
SCHEMBL2389376 0.79 SYK (0.40) MAPKAPK5SYK
SCHEMBL2392164 0.76 MAPKAPK5 (0.65) MAPKAPK5SYK
SCHEMBL12306121 0.75 MAPKAPK5 (0.41) MAPKAPK5SYK
Glpg-0259 SCHEMBL1570157 0.72 MAPKAPK5 (0.49) MAPKAPK5SYKBTK
Glpg-0259 SCHEMBL1889564 0.72 MAPKAPK5 (0.49) MAPKAPK5SYKBTK
Glpg-0259 SCHEMBL12661679 0.72 MAPKAPK5 (0.49) MAPKAPK5SYKBTK

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-20090286798-A1 FUSED PYRAZINE COMPOUNDS USEFUL FOR THE TREATMENT OF DEGENERATIVE AND INFLAMMATORY DISEASES GALAPAGOS NV (BE) 2009-11-19 US claimed
US-8012983-B2 Substituted triazolopyrazines useful for the treatment of degenerative and inflammatory diseases GALAPAGOS NV (BE) 2011-09-06 US disclosed
US-8012983-B2 Substituted triazolopyrazines useful for the treatment of degenerative and inflammatory diseases GALAPAGOS NV (BE) 2011-09-06 US disclosed
US-8012983-B2 Substituted triazolopyrazines useful for the treatment of degenerative and inflammatory diseases GALAPAGOS NV (BE) 2011-09-06 US disclosed
US-20090286798-A1 FUSED PYRAZINE COMPOUNDS USEFUL FOR THE TREATMENT OF DEGENERATIVE AND INFLAMMATORY DISEASES GALAPAGOS NV (BE) 2009-11-19 US disclosed
US-20090286798-A1 FUSED PYRAZINE COMPOUNDS USEFUL FOR THE TREATMENT OF DEGENERATIVE AND INFLAMMATORY DISEASES GALAPAGOS NV (BE) 2009-11-19 US disclosed
US-20090286798-A1 FUSED PYRAZINE COMPOUNDS USEFUL FOR THE TREATMENT OF DEGENERATIVE AND INFLAMMATORY DISEASES GALAPAGOS NV (BE) 2009-11-19 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 (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-20090286798-A1 FUSED PYRAZINE COMPOUNDS USEFUL FOR THE TREATMENT OF DEGENERATIVE AND INFLAMMATORY DISEASES IL1B, IL1A, PTGER1 MAPKAPK5 131/4885SYK 3339/4885BTK 4700/4885

“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.