SCHEMBL3442618

SCHEMBL3442618

Cc1ccsc1C(=O)Nc1cccc(-c2nn3ccccc3c2-c2ccnc(Nc3ccccc3)n2)c1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SLC2A1 P11166 4/20 0.62
▸ MAPK8 P45983 2/20 0.60
▸ MAPK9 P45984 2/20 0.60
▸ MAPK10 P53779 1/20 0.60
▸ KDR P35968 4/20 0.57
▸ AURKA O14965 1/20 0.57
▸ AURKB Q96GD4 1/20 0.57
▸ CDK19 Q9BWU1 1/20 0.57
▸ EGFR P00533 4/20 0.53
▸ ERBB2 P04626 4/20 0.53
▸ CSF1R P07333 2/20 0.50
▸ RET P07949 2/20 0.50
▸ FLT1 P17948 2/20 0.50
▸ MAP4K2 Q12851 2/20 0.50
▸ STK3 Q13188 2/20 0.50
▸ MAP4K5 Q9Y4K4 2/20 0.50
▸ LCK P06239 2/20 0.50
▸ MAP4K4 O95819 1/20 0.50
▸ LRRK2 Q5S007 1/20 0.50
▸ TAOK1 Q7L7X3 1/20 0.50

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
SCHEMBL3442096 0.93 SLC2A1 (0.60) SLC2A1MAPK8MAPK9MAPK10KDR
SCHEMBL13105465 0.87 SLC2A1 (0.62) SLC2A1MAPK8MAPK9MAPK10KDR
SCHEMBL14267260 0.86 MAPK8 (0.67) SLC2A1MAPK8MAPK9MAPK10KDR
SCHEMBL3442630 0.85 MAPK8 (0.68) SLC2A1MAPK8MAPK9MAPK10KDR
SCHEMBL13105468 0.85 SLC2A1 (0.65) SLC2A1MAPK8MAPK9MAPK10KDR
SCHEMBL3442070 0.84 SLC2A1 (0.58) SLC2A1MAPK8MAPK9MAPK10KDR
SCHEMBL3441853 0.84 SLC2A1 (0.58) SLC2A1MAPK8MAPK9MAPK10KDR
SCHEMBL13105474 0.83 SLC2A1 (0.64) SLC2A1MAPK8MAPK9MAPK10KDR
SCHEMBL3442634 0.83 SLC2A1 (0.82) SLC2A1MAPK8MAPK9MAPK10KDR
SCHEMBL13105464 0.83 SLC2A1 (0.65) SLC2A1MAPK8MAPK9MAPK10KDR

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-7812022-B2 2-pyrimidinyl pyrazolopyridine ErbB kinase inhibitors GLAXOSMITHKLINE LLC (US) 2010-10-12 — — US disclosed
US-7812022-B2 2-pyrimidinyl pyrazolopyridine ErbB kinase inhibitors GLAXOSMITHKLINE LLC (US) 2010-10-12 — — US disclosed
US-7812022-B2 2-pyrimidinyl pyrazolopyridine ErbB kinase inhibitors GLAXOSMITHKLINE LLC (US) 2010-10-12 — — US disclosed
EP-1828185-B1 2-PYRIMIDINYL PYRAZOLOPYRIDINE ERBB KINASE INHIBITORS SMITHKLINE BEECHAM CORP (US) 2009-05-06 — — EP disclosed
US-20080051395-A1 2-Pyrimidinyl Pyrazolopyridine Erbb Kinase Inhibitors SMITHKLINE BEECHAM CORPORATION 2008-02-28 — — US disclosed
US-20080051395-A1 2-Pyrimidinyl Pyrazolopyridine Erbb Kinase Inhibitors SMITHKLINE BEECHAM CORPORATION 2008-02-28 — — US disclosed
US-20080051395-A1 2-Pyrimidinyl Pyrazolopyridine Erbb Kinase Inhibitors SMITHKLINE BEECHAM CORPORATION 2008-02-28 — — 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-20080051395-A1 2-Pyrimidinyl Pyrazolopyridine Erbb Kinase Inhibitors ERBB2, ERBB3, ERBB4 SLC2A1 3810/4885MAPK8 263/4885MAPK9 203/4885

“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.

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