SCHEMBL3711032

SCHEMBL3711032

CC(C)CNc1nc(Cl)nc2ccoc12

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 3/20 0.45
SYK P43405 4/20 0.43
ACP1 P24666 1/20 0.40
PDE4A P27815 1/20 0.39
PDE4B Q07343 1/20 0.39
PDE4C Q08493 1/20 0.39
PDE4D Q08499 1/20 0.39
TLR7 Q9NYK1 2/20 0.38
MAPT P10636 1/20 0.36
APP P05067 2/20 0.36
PDE5A O76074 1/20 0.36
USP1 O94782 1/20 0.35
WDR48 Q8TAF3 1/20 0.35
LATS1 O95835 1/20 0.35
LATS2 Q9NRM7 1/20 0.35
CHRM4 P08173 1/20 0.34
MAP4K4 O95819 1/20 0.34
JAK2 O60674 1/20 0.33
ABL1 P00519 1/20 0.33
INSR P06213 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
SCHEMBL1709838 0.85 SYK (0.37) SYKPDE4APDE4BPDE4CPDE4D
SCHEMBL3708672 0.83 PDE4A (0.44) SYKPDE4APDE4BPDE4CPDE4D
SCHEMBL3701517 0.81 PDE4A (0.45) SYKPDE4APDE4BPDE4CPDE4D
SCHEMBL3715489 0.80 SYK (0.41) SYKACP1PDE4APDE4BPDE4C
SCHEMBL3713429 0.78 XDH (0.37) PDE4APDE4BPDE4CPDE4DMAPT
SCHEMBL1709887 0.77 SYK (0.51) SYKPDE4APDE4BPDE4CPDE4D
SCHEMBL3712321 0.75 TLR7 (0.39) SYKPDE4APDE4BPDE4CPDE4D
SCHEMBL31690997 0.75 APP (0.67) ESR1PDE4APDE4BPDE4CPDE4D
SCHEMBL22652133 0.75 PDE4A (0.39) SYKPDE4APDE4BPDE4CPDE4D
SCHEMBL31691093 0.74 PDE5A (0.50) PDE4APDE4BPDE4CPDE4DMAPT

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 ESR1 1598/4885SYK 1176/4885ACP1 3101/4885

“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.