SCHEMBL1657463

SCHEMBL1657463

CS(=O)(=O)c1ccc(-n2ccc3cnc(Nc4ccccc4)nc32)cc1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 12/20 0.65
JAK3 P52333 5/20 0.65
AURKA O14965 3/20 0.65
CDC7 O00311 1/20 0.65
CHEK1 O14757 1/20 0.65
DCLK1 O15075 1/20 0.65
MAPK13 O15264 1/20 0.65
PDPK1 O15530 1/20 0.65
DAPK3 O43293 1/20 0.65
ROCK2 O75116 1/20 0.65
PRKD3 O94806 1/20 0.65
MAP4K4 O95819 1/20 0.65
PAK4 O96013 1/20 0.65
CHEK2 O96017 1/20 0.65
EGFR P00533 1/20 0.65
ERBB2 P04626 1/20 0.65
NTRK1 P04629 1/20 0.65
PRKCG P05129 1/20 0.65
INSR P06213 1/20 0.65
LCK P06239 1/20 0.65

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
SCHEMBL1657524 0.89 AURKA (0.59) JAK2JAK3AURKACDC7CHEK1
SCHEMBL1654524 0.87 PTK2 (0.64) JAK2JAK3AURKADAPK3PAK4
SCHEMBL1657580 0.87 AURKA (0.57) JAK2JAK3AURKACDC7CHEK1
SCHEMBL1654998 0.86 JAK2 (0.58) JAK2JAK3AURKACDC7CHEK1
SCHEMBL1657468 0.86 AURKA (0.56) JAK2JAK3AURKACDC7CHEK1
SCHEMBL1654519 0.85 AURKA (0.55) JAK2JAK3AURKACDC7CHEK1
SCHEMBL11916212 0.85 AURKA (0.68) JAK2JAK3AURKACDC7CHEK1
SCHEMBL4291613 0.84 AURKA (0.54) JAK2JAK3AURKACDC7CHEK1
SCHEMBL1655899 0.84 AURKA (0.81) JAK2JAK3AURKARPS6KA3CDK4
SCHEMBL1655231 0.84 AURKA (0.54) JAK2JAK3AURKACDC7CHEK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2011511034-A 2011-04-07 JP claimed
EP-2247591-A1 PYRROLO [2, 3-D]PYRIDINES AND USE THEREOF AS TYROSINE KINASE INHIBITORS Novartis AG (CH) 2010-11-10 EP claimed
US-20090203688-A1 HETEROCYCLIC COMPOUNDS NOVARTIS AG 2009-08-13 US claimed
WO-2009098236-A1 PYRROLO [2, 3-D] PYRIDINES AND USE THEREOF AS TYROSINE KINASE INHIBITORS NOVARTIS AG (CH) 2009-08-13 WO claimed
US-8420657-B2 Pyrrolo[2,3-D]pyrimidines and use thereof as tyrosine kinase inhibitors NOVARTIS AG (CH) 2013-04-16 US disclosed
US-20090203688-A1 HETEROCYCLIC COMPOUNDS NOVARTIS AG 2009-08-13 US disclosed
US-20090203688-A1 HETEROCYCLIC COMPOUNDS NOVARTIS AG 2009-08-13 US disclosed
WO-2009098236-A1 PYRROLO [2, 3-D] PYRIDINES AND USE THEREOF AS TYROSINE KINASE INHIBITORS NOVARTIS AG (CH) 2009-08-13 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 (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-20090203688-A1 HETEROCYCLIC COMPOUNDS ABL1, JAK2, JAK1 JAK2 2/4885JAK3 16/4885AURKA 755/4885

“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.