SCHEMBL1685331

SCHEMBL1685331

O=C1N=Cc2cc(-c3ccc(Nc4ccc(S(=O)(=O)c5ccccc5)cc4)c4nccn34)ccc21

nearest known ligand 0.34

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAPKAPK5 Q8IW41 3/20 0.34
PTK2 Q05397 2/20 0.32
NAMPT P43490 3/20 0.32
CCNE1 P24864 1/20 0.31
CDK2 P24941 1/20 0.31
IKBKB O14920 1/20 0.31
BRD4 O60885 2/20 0.31
AURKA O14965 2/20 0.30
AURKB Q96GD4 1/20 0.30
MET P08581 1/20 0.30

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
SCHEMBL1685319 0.89 JAK2 (0.36) MAPKAPK5PTK2IKBKBAURKA
SCHEMBL1685332 0.83 MAPKAPK5 (0.51) MAPKAPK5
SCHEMBL3868797 0.83 AURKA (0.49) MAPKAPK5CCNE1CDK2IKBKBAURKA
SCHEMBL3875479 0.82 TNIK (0.38) MAPKAPK5
SCHEMBL1685127 0.80 MAPKAPK5 (0.55) MAPKAPK5
SCHEMBL3875061 0.79 MAPKAPK5 (0.36) MAPKAPK5
SCHEMBL1685204 0.76 RIPK1 (0.43) MAPKAPK5CCNE1CDK2
SCHEMBL3868547 0.76 MAPKAPK5 (0.34) MAPKAPK5
SCHEMBL1685173 0.75 MKNK1 (0.43) IKBKB
SCHEMBL1685151 0.75 CCND1 (0.39) MAPKAPK5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120010206-A1 IMIDAZOLOPYRIDINE COMPOUNDS USEFUL FOR THE TREATMENT OF DEGENERATIVE AND INFLAMMATORY DISEASES GALAPAGOS N. V. (BE) 2012-01-12 US disclosed
US-20090048245-A1 Imidazolopyridine compounds useful for the treatment of degenerative and inflammatory diseases GALAPAGOS NV (BE) 2009-02-19 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 (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-20120010206-A1 IMIDAZOLOPYRIDINE COMPOUNDS USEFUL FOR THE TREATMENT OF DEGENERATIVE AND INFLAMMATORY DISEASES COL2A1, MMP1, COL1A1 MAPKAPK5 19/4885PTK2 71/4885NAMPT 526/4885
US-20090048245-A1 Imidazolopyridine compounds useful for the treatment of degenerative and inflammatory diseases COL2A1, MMP1, COL1A1 MAPKAPK5 19/4885PTK2 71/4885NAMPT 526/4885

“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.