SCHEMBL4007014

SCHEMBL4007014

CC(C)Oc1cc(Nc2cc(Cl)nc(Cl)n2)n[nH]1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 3/20 0.38
PIK3C3 Q8NEB9 4/20 0.36
GSK3B P49841 2/20 0.36
PAK4 O96013 2/20 0.36
PLK4 O00444 1/20 0.36
JAK2 O60674 3/20 0.33
JAK3 P52333 2/20 0.33
ESR1 P03372 1/20 0.33
RET P07949 2/20 0.33
AURKA O14965 1/20 0.33
DAPK3 O43293 1/20 0.33
ABL1 P00519 1/20 0.33
LCK P06239 1/20 0.33
FYN P06241 1/20 0.33
CSF1R P07333 1/20 0.33
PDGFRB P09619 1/20 0.33
FGFR1 P11362 1/20 0.33
FLT1 P17948 1/20 0.33
LTK P29376 1/20 0.33
KDR P35968 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
SCHEMBL4014076 0.88 IGF1R (0.38) IGF1RPIK3C3PAK4PLK4JAK2
SCHEMBL219259 0.84 PAK4 (0.38) IGF1RPIK3C3GSK3BPAK4PLK4
SCHEMBL4065934 0.81 PLK4 (0.40) IGF1RPAK4PLK4JAK2JAK3
SCHEMBL27674569 0.81 ITK (0.40) IGF1RPIK3C3PAK4AURKAFGFR1
SCHEMBL22328001 0.81 NPC1 (0.40) IGF1RPIK3C3JAK2JAK3LRRK2
SCHEMBL2321825 0.78 IGF1R (0.56) IGF1RPAK4PLK4FGFR1KDR
SCHEMBL220024 0.77 JAK2 (0.47) IGF1RPAK4PLK4JAK2JAK3
SCHEMBL220647 0.76 PAK4 (0.57) IGF1RPIK3C3GSK3BPAK4PLK4
SCHEMBL4064988 0.76 JAK2 (0.43) IGF1RPAK4PLK4JAK2JAK3
SCHEMBL218889 0.76 IGF1R (0.44) IGF1RPAK4PLK4JAK2JAK3

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
EP-2044063-A1 PYRIMIDINE DERIVATIVES USEFUL IN THE TREATMENT OF CANCER Astra Zeneca AB (SE) 2009-04-08 EP disclosed
WO-2008001070-A1 PYRIMIDINE DERIVATIVES USEFUL IN THE TREATMENT OF CANCER ASTRAZENECA AB (SE) 2008-01-03 WO disclosed
US-20080004302-A1 Novel Compounds ASTRAZENECA AB (SE) 2008-01-03 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-20080004302-A1 Novel Compounds CYP11B2, CYP11B1, CYP46A1 IGF1R 3217/4885PIK3C3 4104/4885GSK3B 1552/4885

“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.