SCHEMBL4295030

SCHEMBL4295030

OC1CCN(Cc2ccc(Nc3ncc4ccn(-c5cc(F)c(CN6CCOCC6)c(F)c5)c4n3)cn2)C1

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
RPS6KA3 P51812 3/20 0.49
STAT6 P42226 5/20 0.43
JAK2 O60674 6/20 0.40
BRD4 O60885 6/20 0.40
AURKA O14965 2/20 0.39
CDK4 P11802 1/20 0.39
MAPK8 P45983 1/20 0.39
TBK1 Q9UHD2 1/20 0.39
LRRK2 Q5S007 1/20 0.38
JAK3 P52333 1/20 0.38
AURKB Q96GD4 1/20 0.37

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
SCHEMBL1656272 0.91 RPS6KA3 (0.54) RPS6KA3STAT6JAK2BRD4AURKA
SCHEMBL1655374 0.90 RPS6KA3 (0.48) RPS6KA3STAT6JAK2BRD4CDK4
SCHEMBL4292044 0.88 RPS6KA3 (0.53) RPS6KA3STAT6JAK2BRD4AURKA
SCHEMBL1654504 0.88 RPS6KA3 (0.47) RPS6KA3STAT6JAK2BRD4TBK1
SCHEMBL3399893 0.87 RPS6KA3 (0.50) RPS6KA3STAT6JAK2BRD4JAK3
SCHEMBL1653396 0.87 RPS6KA3 (0.51) RPS6KA3STAT6JAK2BRD4AURKA
SCHEMBL1655824 0.85 RPS6KA3 (0.52) RPS6KA3STAT6JAK2BRD4AURKA
SCHEMBL13756783 0.83 STAT6 (0.39) STAT6JAK2BRD4AURKALRRK2
SCHEMBL1655426 0.82 RPS6KA3 (0.46) RPS6KA3STAT6JAK2BRD4AURKA
SCHEMBL1655183 0.82 RPS6KA3 (0.49) RPS6KA3STAT6JAK2BRD4AURKA

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 5 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
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 RPS6KA3 303/4885STAT6 601/4885JAK2 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.