SCHEMBL1685187

SCHEMBL1685187

c1cn2c(-c3cn[nH]c3)ccc(Nc3ccc(N4CCOCC4)cc3)c2n1

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPKAPK5 Q8IW41 13/20 0.75
AURKA O14965 2/20 0.54
AURKB Q96GD4 1/20 0.54
FYN P06241 1/20 0.48
PTK6 Q13882 2/20 0.45
BMPR1B O00238 1/20 0.44
KDR P35968 1/20 0.44
BMPR1A P36894 1/20 0.44
ACVR1B P36896 1/20 0.44
TGFBR1 P36897 1/20 0.44
ACVRL1 P37023 1/20 0.44
TGFBR2 P37173 1/20 0.44
ACVR1 Q04771 1/20 0.44
BMPR2 Q13873 1/20 0.44
PRKAB1 Q9Y478 1/20 0.44
MAPK10 P53779 1/20 0.44
JAK2 O60674 1/20 0.43
NTRK1 P04629 1/20 0.43
ROS1 P08922 1/20 0.43
CSNK2A2 P19784 1/20 0.43

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
SCHEMBL1685211 0.89 MAPKAPK5 (0.60) MAPKAPK5AURKAAURKBFYNPTK6
SCHEMBL1685214 0.89 MAPKAPK5 (0.60) MAPKAPK5AURKAAURKBFYNJAK2
SCHEMBL1685203 0.87 MAPKAPK5 (0.58) MAPKAPK5AURKAAURKBFYNPTK6
SCHEMBL10134376 0.86 MAPKAPK5 (0.57) MAPKAPK5AURKAAURKBFYNPTK6
SCHEMBL13922409 0.86 MAPKAPK5 (0.57) MAPKAPK5AURKAAURKBFYNPTK6
SCHEMBL1674055 0.86 MAPKAPK5 (1.00) MAPKAPK5AURKAAURKBFYNPTK6
SCHEMBL10134440 0.85 MAPKAPK5 (0.56) MAPKAPK5AURKAAURKBACVR1SYK
SCHEMBL1685215 0.85 MAPKAPK5 (0.56) MAPKAPK5AURKAAURKBFYNPTK6
SCHEMBL10134492 0.84 MAPKAPK5 (0.55) MAPKAPK5AURKAAURKBFYNPTK6
SCHEMBL1685279 0.84 MAPKAPK5 (0.55) MAPKAPK5AURKAAURKBFYNPTK6

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 11 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-20120010206-A1 IMIDAZOLOPYRIDINE COMPOUNDS USEFUL FOR THE TREATMENT OF DEGENERATIVE AND INFLAMMATORY DISEASES GALAPAGOS N. V. (BE) 2012-01-12 US disclosed
US-20120010206-A1 IMIDAZOLOPYRIDINE COMPOUNDS USEFUL FOR THE TREATMENT OF DEGENERATIVE AND INFLAMMATORY DISEASES GALAPAGOS N. V. (BE) 2012-01-12 US disclosed
US-7951818-B2 Imidazolopyridine compounds useful for the treatment of degenerative and inflammatory diseases GALAPAGOS NV (BE) 2011-05-31 US disclosed
US-7951818-B2 Imidazolopyridine compounds useful for the treatment of degenerative and inflammatory diseases GALAPAGOS NV (BE) 2011-05-31 US disclosed
US-7951818-B2 Imidazolopyridine compounds useful for the treatment of degenerative and inflammatory diseases GALAPAGOS NV (BE) 2011-05-31 US disclosed
EP-2099798-A1 IMIDAZOLOPYRIDINE COMPOUNDS USEFUL FOR THE TREATMENT OF DEGENERATIVE AND INFLAMMATORY DISEASES Galapagos N.V. (BE) 2009-09-16 EP disclosed
US-20090048245-A1 Imidazolopyridine compounds useful for the treatment of degenerative and inflammatory diseases GALAPAGOS NV (BE) 2009-02-19 US disclosed
US-20090048245-A1 Imidazolopyridine compounds useful for the treatment of degenerative and inflammatory diseases GALAPAGOS NV (BE) 2009-02-19 US disclosed
WO-2008065199-A1 IMIDAZOLOPYRIDINE COMPOUNDS USEFUL FOR THE TREATMENT OF DEGENERATIVE AND INFLAMMATORY DISEASES GALAPAGOS N.V. (BE) 2008-06-05 WO disclosed
WO-2008065199-A1 IMIDAZOLOPYRIDINE COMPOUNDS USEFUL FOR THE TREATMENT OF DEGENERATIVE AND INFLAMMATORY DISEASES GALAPAGOS N.V. (BE) 2008-06-05 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-20120010206-A1 IMIDAZOLOPYRIDINE COMPOUNDS USEFUL FOR THE TREATMENT OF DEGENERATIVE AND INFLAMMATORY DISEASES COL2A1, MMP1, COL1A1 MAPKAPK5 19/4885AURKA 3833/4885AURKB 3410/4885
US-20090048245-A1 Imidazolopyridine compounds useful for the treatment of degenerative and inflammatory diseases COL2A1, MMP1, COL1A1 MAPKAPK5 19/4885AURKA 3833/4885AURKB 3410/4885

“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.