SCHEMBL9918666

SCHEMBL9918666

CC(=O)c1nnc2[nH]ccc2c1O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
JAK3 P52333 3/20 0.38
PRKD3 O94806 2/20 0.38
MAP4K4 O95819 2/20 0.38
PAK4 O96013 2/20 0.38
PDGFRB P09619 2/20 0.38
PDGFRA P16234 2/20 0.38
LTK P29376 2/20 0.38
KDR P35968 2/20 0.38
CLK2 P49760 2/20 0.38
CDK7 P50613 2/20 0.38
CDK5 Q00535 2/20 0.38
MST1R Q04912 2/20 0.38
LRRK2 Q5S007 2/20 0.38
CLK4 Q9HAZ1 2/20 0.38
DYRK1B Q9Y463 2/20 0.38
DYRK1A Q13627 2/20 0.38
DAPK3 O43293 1/20 0.38
JAK2 O60674 1/20 0.38
ABL1 P00519 1/20 0.38
CSF1R P07333 1/20 0.38

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
SCHEMBL12833213 0.84 EGLN1 (0.38) JAK3DYRK1AJAK2TTBK1TTBK2
SCHEMBL9918650 0.69 AXL (0.41) JAK3JAK2NOTUM
SCHEMBL12832928 0.69 LRRK2 (0.45) JAK3LRRK2JAK2NUDT1IKBKB
SCHEMBL9918651 0.68 PRKCI (0.40) JAK3JAK2NUDT1SYKCDK8
SCHEMBL9921698 0.67 TTBK1 (0.31) TTBK1TTBK2
SCHEMBL9918659 0.67 TTBK1 (0.31) TTBK1TTBK2
SCHEMBL24628649 0.66 JAK2 (0.42) JAK3PRKD3MAP4K4PAK4PDGFRB
SCHEMBL9918654 0.65 NUDT1 (0.52) JAK3NUDT1
SCHEMBL3254384 0.63 NUDT1 (0.63) JAK3PRKD3MAP4K4PAK4PDGFRB
SCHEMBL15059574 0.63 PDE3B (0.61) JAK3PRKD3MAP4K4PAK4PDGFRB

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-20120149662-A1 Heterocyclic Compounds as Janus Kinase Inhibitors BIOCRYST PHARMACEUTICALS, INC. (US) 2012-06-14 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-20120149662-A1 Heterocyclic Compounds as Janus Kinase Inhibitors JAK2, JAK1, JAK3 JAK3 3/4885PRKD3 473/4885MAP4K4 44/4885

“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.