SCHEMBL3705307

SCHEMBL3705307

CC1(CNc2nc(Cl)nc3ccoc23)COC1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MBOAT4 Q96T53 4/20 0.37
PDE4A P27815 1/20 0.36
PDE4B Q07343 1/20 0.36
PDE4C Q08493 1/20 0.36
PDE4D Q08499 1/20 0.36
SYK P43405 8/20 0.34
JAK2 O60674 2/20 0.34
ABL1 P00519 2/20 0.34
INSR P06213 2/20 0.34
LCK P06239 2/20 0.34
FYN P06241 2/20 0.34
RET P07949 2/20 0.34
MST1 P26927 2/20 0.34
MAPK8 P45983 2/20 0.34
TNK2 Q07912 2/20 0.34
MAP4K2 Q12851 2/20 0.34
NTRK2 Q16620 2/20 0.34
TTK P33981 2/20 0.34
APP P05067 2/20 0.33
PDE5A O76074 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
SCHEMBL3708672 0.78 PDE4A (0.44) PDE4APDE4BPDE4CPDE4DSYK
SCHEMBL3701517 0.75 PDE4A (0.45) PDE4APDE4BPDE4CPDE4DSYK
SCHEMBL3706397 0.74 LATS1 (0.36) PDE4APDE4BPDE4CPDE4DSYK
SCHEMBL3711032 0.74 ESR1 (0.45) PDE4APDE4BPDE4CPDE4DSYK
SCHEMBL3712321 0.73 TLR7 (0.39) PDE4APDE4BPDE4CPDE4DSYK
SCHEMBL3713429 0.73 XDH (0.37) PDE4APDE4BPDE4CPDE4DAPP
SCHEMBL1709838 0.71 SYK (0.37) PDE4APDE4BPDE4CPDE4DSYK
SCHEMBL1709887 0.71 SYK (0.51) PDE4APDE4BPDE4CPDE4DSYK
SCHEMBL31690997 0.70 APP (0.67) PDE4APDE4BPDE4CPDE4DAPP
SCHEMBL16595168 0.70 PDE4A (0.34) PDE4APDE4BPDE4CPDE4DSYK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8551981-B2 Furo[3,2-d]pyrimidine compounds ABBVIE INC. (US) 2013-10-08 US disclosed
US-20120122846-A1 FURO[3,2-d]PYRIMIDINE COMPOUNDS ABBOTT LABORATORIES (US) 2012-05-17 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-20120122846-A1 FURO[3,2-d]PYRIMIDINE COMPOUNDS CDK2, DPYD, CDK3 MBOAT4 4846/4885PDE4A 1055/4885PDE4B 1241/4885

“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.