SCHEMBL17364326

SCHEMBL17364326

O=c1ccn(-c2nc(Cl)nc3[nH]cnc23)cc1

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AURKA O14965 2/20 0.33
DAPK3 O43293 2/20 0.33
PRKD3 O94806 2/20 0.33
MAP4K4 O95819 2/20 0.33
RET P07949 2/20 0.33
IGF1R P08069 2/20 0.33
PIM1 P11309 2/20 0.33
CLK2 P49760 2/20 0.33
GSK3A P49840 2/20 0.33
GSK3B P49841 2/20 0.33
PRKX P51817 2/20 0.33
BTK Q06187 2/20 0.33
TYRO3 Q06418 2/20 0.33
DYRK1A Q13627 2/20 0.33
NTRK3 Q16288 2/20 0.33
TAOK1 Q7L7X3 2/20 0.33
CLK4 Q9HAZ1 2/20 0.33
ALK Q9UM73 2/20 0.33
JAK2 O60674 1/20 0.33
PAK4 O96013 1/20 0.33

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
SCHEMBL17364330 0.82 ADORA2A (0.40) PARP1ADORA2AADORA1KDM4AKDM4B
SCHEMBL17364278 0.77 ADORA2A (0.33) PARP1ADORA2AADORA1
SCHEMBL17364302 0.77 CA12 (0.39) JAK2PARP1JAK3ADORA2AADORA1
SCHEMBL3799223 0.77 NOTUM (0.36) CLK4MKNK2
SCHEMBL17364327 0.77 XDH (0.44) ADORA2AADORA1
SCHEMBL17364287 0.75 PDPK1 (0.40) AURKADAPK3PRKD3MAP4K4RET
SCHEMBL30677329 0.71
SCHEMBL14183741 0.71 HTT (0.41) JAK3ADORA2AADORA1
SCHEMBL17856868 0.71 KDM4A (0.47) ADORA2AADORA1KDM4AKDM4BKDM5C
SCHEMBL4127174 0.70 BIRC5 (0.41) PRKD3PRKACAMAPK8MAPK9PRKCQ

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150376219-A1 Selective Preparations of Purine Nucleosides and Nucleotides: Reagents and Methods ZHONG MINGHONG (US) 2015-12-31 US disclosed
US-20150376219-A1 Selective Preparations of Purine Nucleosides and Nucleotides: Reagents and Methods ZHONG MINGHONG (US) 2015-12-31 US disclosed
US-20150376219-A1 Selective Preparations of Purine Nucleosides and Nucleotides: Reagents and Methods ZHONG MINGHONG (US) 2015-12-31 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-20150376219-A1 Selective Preparations of Purine Nucleosides and Nucleotides: Reagents and Methods PNP, ATIC, NT5C3B AURKA 2865/4885DAPK3 2808/4885PRKD3 716/4885

“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.