SCHEMBL4923149

SCHEMBL4923149

CC1(C)Cc2c(c(N3CCOCC3)nc3oc4c(N(CCO)CCN5CCOCC5)ncnc4c23)CO1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 13/20 1.00
PDE4A P27815 7/20 0.78
PDE4D Q08499 7/20 0.78
KDM4E B2RXH2 4/20 0.46
ALDH1A1 P00352 3/20 0.46
ADRB2 P07550 2/20 0.46
MAPT P10636 1/20 0.46
LMNA P02545 2/20 0.44
NPSR1 Q6W5P4 2/20 0.44
HIF1A Q16665 1/20 0.44
USP2 O75604 1/20 0.44
HPGD P15428 1/20 0.44
MAPK1 P28482 1/20 0.44
HTT P42858 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
HSD17B10 Q99714 1/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 1/20 0.44
RXFP1 Q9HBX9 1/20 0.44
RAB9A P51151 1/20 0.43

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
SCHEMBL4710435 0.90 PDE4B (0.82) PDE4BPDE4APDE4DKDM4EALDH1A1
SCHEMBL4706624 0.88 PDE4B (1.00) PDE4BPDE4APDE4DKDM4EALDH1A1
SCHEMBL4923982 0.86 PDE4B (0.77) PDE4BPDE4APDE4DKDM4EALDH1A1
SCHEMBL5013091 0.84 PDE4B (1.00) PDE4BPDE4APDE4DKDM4EALDH1A1
SCHEMBL4922055 0.80 PDE4B (1.00) PDE4BPDE4APDE4DKDM4EALDH1A1
SCHEMBL4708784 0.80 PDE4B (0.83) PDE4BPDE4APDE4D
SCHEMBL4709819 0.79 PDE4B (0.69) PDE4BPDE4APDE4DKDM4EALDH1A1
SCHEMBL5012465 0.79 PDE4B (0.91) PDE4BPDE4APDE4DKDM4EALDH1A1
SCHEMBL4923387 0.78 PDE4B (0.80) PDE4BPDE4APDE4D
SCHEMBL4048347 0.74 PDE4B (0.88) PDE4BPDE4APDE4DKDM4EALDH1A1

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-20080221096-A1 Pyrido[3' ,2':4,5]Furo[3,2-d]Pyrimidine Derivatives LABORATORIOS ALMIRALL, S.A. (ES) 2008-09-11 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-20080221096-A1 Pyrido[3' ,2':4,5]Furo[3,2-d]Pyrimidine Derivatives NR1H2, CBR3, NR4A1 PDE4B 4185/4885PDE4A 3960/4885PDE4D 4404/4885

“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.