SCHEMBL4284002

SCHEMBL4284002

OC(O)(c1c(F)cc(-n2ccc3cnc(Nc4ccccc4)nc32)cc1F)N1CCSCC1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RPS6KA3 P51812 3/20 0.47
JAK2 O60674 14/20 0.44
BRD4 O60885 13/20 0.44
JAK3 P52333 5/20 0.44
AURKA O14965 3/20 0.44
CDC7 O00311 1/20 0.44
CHEK1 O14757 1/20 0.44
DCLK1 O15075 1/20 0.44
MAPK13 O15264 1/20 0.44
PDPK1 O15530 1/20 0.44
DAPK3 O43293 1/20 0.44
ROCK2 O75116 1/20 0.44
PRKD3 O94806 1/20 0.44
MAP4K4 O95819 1/20 0.44
PAK4 O96013 1/20 0.44
CHEK2 O96017 1/20 0.44
EGFR P00533 1/20 0.44
ERBB2 P04626 1/20 0.44
NTRK1 P04629 1/20 0.44
PRKCG P05129 1/20 0.44

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
SCHEMBL1657537 0.92 AURKA (0.46) RPS6KA3JAK2BRD4JAK3AURKA
SCHEMBL4290779 0.92 RPS6KA3 (0.46) RPS6KA3JAK2BRD4JAK3AURKA
SCHEMBL4293675 0.89 JAK2 (0.43) RPS6KA3JAK2BRD4JAK3AURKA
SCHEMBL4290429 0.89 PTK2 (0.44) RPS6KA3JAK2BRD4AURKACDK2
SCHEMBL1657502 0.88 RPS6KA3 (0.45) RPS6KA3JAK2BRD4JAK3JAK1
SCHEMBL4288938 0.88 RPS6KA3 (0.45) RPS6KA3JAK2BRD4JAK3EGFR
SCHEMBL4283799 0.87 SYK (0.43) RPS6KA3JAK2BRD4JAK3AURKA
SCHEMBL4288414 0.87 JAK2 (0.45) RPS6KA3JAK2BRD4JAK3AURKA
SCHEMBL4286086 0.86 RPS6KA3 (0.44) RPS6KA3JAK2BRD4JAK3EGFR
SCHEMBL4287611 0.85 JAK2 (0.42) RPS6KA3JAK2BRD4JAK3FGFR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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

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 303/4885JAK2 2/4885BRD4 964/4885

“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.