SCHEMBL4266481

SCHEMBL4266481

Cn1nc(-c2cc(OCF)cc(OCF)c2)c2cnc(N)nc21

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TLR7 Q9NYK1 9/20 0.48
▸ TLR9 Q9NR96 9/20 0.48
▸ TLR8 Q9NR97 9/20 0.48
▸ FGFR1 P11362 2/20 0.39
▸ FGFR2 P21802 1/20 0.39
▸ FGFR4 P22455 1/20 0.39
▸ FGFR3 P22607 1/20 0.39
▸ PIK3CA P42336 3/20 0.37
▸ MTOR P42345 3/20 0.37
▸ RICTOR Q6R327 1/20 0.37
▸ RPTOR Q8N122 1/20 0.37
▸ MAPKAP1 Q9BPZ7 1/20 0.37
▸ MLST8 Q9BVC4 1/20 0.37
▸ PIK3CD O00329 2/20 0.34
▸ ABL1 P00519 2/20 0.34
▸ EGFR P00533 2/20 0.34
▸ HCK P08631 2/20 0.34
▸ SRC P12931 2/20 0.34
▸ KDR P35968 2/20 0.34
▸ PIK3CB P42338 2/20 0.34

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
SCHEMBL4218178 0.80 TLR7 (0.50) TLR7TLR9TLR8PIK3CAMTOR
SCHEMBL4225393 0.79 LDHA (0.47) TLR7TLR9TLR8FGFR1FGFR2
SCHEMBL4219353 0.79 TLR7 (0.54) TLR7TLR9TLR8FGFR1FGFR2
SCHEMBL4215536 0.77 TLR7 (0.53) TLR7TLR9TLR8FGFR1FGFR2
SCHEMBL4220662 0.76 TLR7 (0.54) TLR7TLR9TLR8PIK3CAMTOR
SCHEMBL4222317 0.75 TLR7 (0.47) TLR7TLR9TLR8PIK3CAMTOR
SCHEMBL4045726 0.75 KMT2A (0.57) TLR7TLR9TLR8SRCKDR
SCHEMBL4217093 0.74 TLR7 (0.53) TLR7TLR9TLR8PIK3CAMTOR
SCHEMBL4054719 0.74 TLR7 (0.46) TLR7TLR9TLR8PIK3CAMTOR
SCHEMBL4054519 0.74 TLR7 (0.48) TLR7TLR9TLR8PIK3CAMTOR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090131457-A1 Pyrazolo [3,4-D] Pyrimidine Derivatives Useful to Treat Respiratory Disorders NOVARTIS AG (CH) 2009-05-21 — — 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-20090131457-A1 Pyrazolo [3,4-D] Pyrimidine Derivatives Useful to Treat Respiratory Disorders PIK3CA, JAK3, PDK1 TLR7 1301/4885TLR9 1750/4885TLR8 2531/4885

“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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