SCHEMBL309519

SCHEMBL309519

COc1cc(N2CCC(N3CCN(CCS(C)(=O)=O)CC3)CC2)ccc1Nc1nccc(-c2c(-c3cccc(C(=O)Nc4c(F)cccc4F)c3)nc3c(C)cccn23)n1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
INSR P06213 14/20 1.00
IGF1R P08069 10/20 0.85
MAPK14 Q16539 2/20 0.72
AURKA O14965 1/20 0.72
EGFR P00533 1/20 0.72
ERBB2 P04626 1/20 0.72
LCK P06239 1/20 0.72
BRAF P15056 1/20 0.72
ERBB4 Q15303 1/20 0.72
AURKB Q96GD4 1/20 0.72

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
SCHEMBL311690 0.97 INSR (1.00) INSRIGF1RMAPK14AURKAEGFR
SCHEMBL310321 0.94 INSR (0.94) INSRIGF1RMAPK14EGFRERBB2
SCHEMBL310469 0.92 INSR (1.00) INSRIGF1RMAPK14AURKAEGFR
SCHEMBL311107 0.92 INSR (0.88) INSRIGF1RMAPK14AURKAEGFR
SCHEMBL325010 0.91 INSR (1.00) INSRIGF1RMAPK14EGFRERBB2
SCHEMBL310995 0.91 INSR (1.00) INSRIGF1RMAPK14EGFRERBB2
SCHEMBL310091 0.90 INSR (0.84) INSRIGF1RMAPK14AURKAEGFR
SCHEMBL13226168 0.90 INSR (0.86) INSRIGF1RMAPK14AURKAEGFR
SCHEMBL309903 0.89 INSR (1.00) INSRIGF1RMAPK14AURKAEGFR
SCHEMBL13226166 0.88 INSR (0.87) INSRIGF1RMAPK14AURKAEGFR

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
EP-2162454-B1 IMIDAZOPYRIDINE KINASE INHIBITORS GLAXOSMITHKLINE LLC (US) 2013-01-02 EP disclosed
US-8093239-B2 Imidazopyridine kinase inhibitors GLAXOSMITHKLINE LLC (US) 2012-01-10 US disclosed
US-8093239-B2 Imidazopyridine kinase inhibitors GLAXOSMITHKLINE LLC (US) 2012-01-10 US disclosed
US-8093239-B2 Imidazopyridine kinase inhibitors GLAXOSMITHKLINE LLC (US) 2012-01-10 US disclosed
US-20100216779-A1 Imidazopyridine Kinase Inhibitors GLAXOSMITHKLINE LLC 2010-08-26 US disclosed
US-20100216779-A1 Imidazopyridine Kinase Inhibitors GLAXOSMITHKLINE LLC 2010-08-26 US disclosed
US-20100216779-A1 Imidazopyridine Kinase Inhibitors GLAXOSMITHKLINE LLC 2010-08-26 US disclosed
WO-2008150799-A1 IMIDAZOPYRIDINE KINASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2008-12-11 WO disclosed
US-20080300242-A1 Imidazopyridine Kinase Inhibitors GLAXOSMITHKLINE LLC 2008-12-04 US disclosed
US-20080300242-A1 Imidazopyridine Kinase Inhibitors GLAXOSMITHKLINE LLC 2008-12-04 US disclosed
US-20080300242-A1 Imidazopyridine Kinase Inhibitors GLAXOSMITHKLINE LLC 2008-12-04 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-20080300242-A1 Imidazopyridine Kinase Inhibitors ABL1, MAP3K19, MAP3K5 INSR 814/4885IGF1R 633/4885MAPK14 333/4885
US-20100216779-A1 Imidazopyridine Kinase Inhibitors ABL1, MAP3K19, MAP3K5 INSR 814/4885IGF1R 633/4885MAPK14 333/4885

“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.