SCHEMBL4151807

SCHEMBL4151807

Cc1c(N)nc(N[C@@H](C)c2ccc(F)cc2)nc1-c1cc(C2CC2)[nH]n1

nearest known ligand 0.54

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
NTRK1 P04629 16/20 0.54
JAK2 O60674 2/20 0.47
JAK3 P52333 1/20 0.47
MKNK1 Q9BUB5 1/20 0.40
MKNK2 Q9HBH9 1/20 0.40
IGF1R P08069 3/20 0.40

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
SCHEMBL3341173 0.91 NTRK1 (0.55) NTRK1JAK2JAK3MKNK1MKNK2
SCHEMBL4152477 0.91 NTRK1 (0.55) NTRK1JAK2JAK3MKNK1MKNK2
SCHEMBL4151428 0.90 NTRK1 (0.49) NTRK1IGF1R
SCHEMBL4159909 0.87 NTRK1 (0.57) NTRK1JAK2JAK3MKNK1MKNK2
SCHEMBL4073888 0.85 NTRK1 (0.53) NTRK1JAK2JAK3MKNK1MKNK2
SCHEMBL4071743 0.84 NTRK1 (0.47) NTRK1JAK2JAK3
SCHEMBL15209257 0.84 PAK1 (0.53) NTRK1IGF1R
SCHEMBL4162039 0.82 NTRK1 (0.62) NTRK1JAK2JAK3IGF1R
SCHEMBL4147398 0.82 NTRK1 (0.52) NTRK1JAK2JAK3IGF1R
SCHEMBL4075878 0.82 NTRK1 (0.49) NTRK1JAK2JAK3

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-20090005396-A1 Use of Pyrazolyl-Pyrimidine Derivatives in the Treatment of Pain ASTRAZENECA AB (SE) 2009-01-01 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-20090005396-A1 Use of Pyrazolyl-Pyrimidine Derivatives in the Treatment of Pain P2RX3, DPYD, TYMP NTRK1 3656/4885JAK2 1971/4885JAK3 1598/4885

“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.