SCHEMBL4293250

SCHEMBL4293250

CS(=O)(=O)c1ccc(-n2ccc3cnc(Nc4ccc(CN5CCCCC5)cc4)nc32)cc1

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ AURKA O14965 2/20 0.56
▸ CDK4 P11802 2/20 0.56
▸ JAK2 O60674 15/20 0.53
▸ BRD4 O60885 8/20 0.53
▸ HDAC6 Q9UBN7 2/20 0.51
▸ JAK3 P52333 5/20 0.51
▸ PTK2 Q05397 4/20 0.51
▸ FGFR4 P22455 1/20 0.49
▸ RIPK2 O43353 1/20 0.46
▸ ACVR1 Q04771 1/20 0.46
▸ NOD2 Q9HC29 1/20 0.46

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
SCHEMBL1655049 0.92 AURKA (0.64) AURKACDK4JAK2BRD4HDAC6
SCHEMBL1655013 0.91 JAK2 (0.61) AURKACDK4JAK2BRD4HDAC6
SCHEMBL1655187 0.91 AURKA (0.54) AURKACDK4JAK2BRD4HDAC6
SCHEMBL3399191 0.90 JAK2 (0.62) AURKACDK4JAK2BRD4HDAC6
SCHEMBL3399195 0.89 AURKA (0.55) AURKACDK4JAK2BRD4HDAC6
SCHEMBL1657573 0.89 AURKA (0.55) AURKACDK4JAK2BRD4HDAC6
SCHEMBL1655002 0.89 JAK2 (0.54) AURKACDK4JAK2BRD4HDAC6
SCHEMBL3403256 0.89 AURKA (0.52) AURKACDK4JAK2BRD4HDAC6
SCHEMBL27916041 0.86 JAK2 (0.50) AURKACDK4JAK2BRD4HDAC6
SCHEMBL1653405 0.86 AURKA (0.53) AURKACDK4JAK2BRD4HDAC6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090203688-A1 HETEROCYCLIC COMPOUNDS NOVARTIS AG 2009-08-13 — — US 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
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 AURKA 755/4885CDK4 186/4885JAK2 2/4885

“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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