SCHEMBL19960797

SCHEMBL19960797

CNCc1cc(C)c(-c2nc3c(-c4ccc(N5CCN(C)CC5)cc4)n[nH]c3cc2C#N)c(F)c1

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAP4K1 Q92918 18/20 0.46
NTRK1 P04629 1/20 0.43
KIT P10721 1/20 0.43
FLT3 P36888 1/20 0.43
JAK3 P52333 1/20 0.40
FGFR1 P11362 1/20 0.40
FGFR2 P21802 1/20 0.40
FGFR3 P22607 1/20 0.40
ACVR1 Q04771 1/20 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
SCHEMBL19949834 0.93 MAP4K1 (0.41) MAP4K1NTRK1KITFLT3JAK3
SCHEMBL19949869 0.89 MAP4K1 (0.45) MAP4K1NTRK1KITFLT3FGFR1
SCHEMBL19949764 0.88 MAP4K1 (0.46) MAP4K1NTRK1KITFLT3JAK3
SCHEMBL19949830 0.83 MAP4K1 (0.63) MAP4K1NTRK1KITFLT3FGFR1
SCHEMBL19949930 0.82 MAP4K1 (0.44) MAP4K1NTRK1KITFLT3FGFR3
SCHEMBL19949915 0.81 MAP4K1 (0.64) MAP4K1NTRK1KITFLT3
SCHEMBL23962856 0.80 MAP4K1 (0.38) MAP4K1NTRK1KITFLT3FGFR1
SCHEMBL19964796 0.79 MAP4K1 (0.42) MAP4K1NTRK1KITFLT3FGFR3
SCHEMBL19949874 0.79 NTRK1 (0.44) MAP4K1NTRK1KITFLT3
SCHEMBL19949819 0.79 MAP4K1 (0.47) MAP4K1FLT3JAK3FGFR1FGFR2

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-20180072718-A1 PYRAZOLOPYRIDINE COMPOUNDS AND USES THEREOF INCYTE CORPORATION 2018-03-15 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-20180072718-A1 PYRAZOLOPYRIDINE COMPOUNDS AND USES THEREOF PDXK, PCK1, PGK1 MAP4K1 41/4885NTRK1 2377/4885KIT 852/4885

“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.