SCHEMBL4912229

SCHEMBL4912229

CCOC(=O)c1nn(-c2ccccc2Cl)c(-c2ccc(O)cc2)c1CO

nearest known ligand 0.51

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 3/20 0.51
PDE4A P27815 2/20 0.48
PDE4C Q08493 2/20 0.48
PDE4D Q08499 2/20 0.48
ALDH1A1 P00352 3/20 0.47
NPSR1 Q6W5P4 1/20 0.47
CNR1 P21554 7/20 0.46
CYP3A4 P08684 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
CYP19A1 P11511 1/20 0.42

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
SCHEMBL4184217 0.93 CNR1 (0.53) PDE4BPDE4APDE4CPDE4DCNR1
SCHEMBL4910813 0.88 PDE4B (0.54) PDE4BPDE4APDE4CPDE4DALDH1A1
SCHEMBL4689858 0.83 CNR1 (0.52) PDE4BPDE4APDE4CPDE4DCNR1
SCHEMBL4193262 0.82 CNR1 (0.60) CNR1
SCHEMBL974512 0.82 PDE4B (0.54) PDE4BPDE4APDE4CPDE4DALDH1A1
SCHEMBL5484151 0.82 PDE4B (0.54) PDE4BPDE4APDE4CPDE4DALDH1A1
SCHEMBL5339252 0.82 CNR1 (0.51) PDE4BCNR1CYP19A1
SCHEMBL4695480 0.81 PDE4B (0.53) PDE4BPDE4APDE4CPDE4DALDH1A1
SCHEMBL4634228 0.81 CNR1 (0.69) CNR1
SCHEMBL4911793 0.81 CNR1 (0.41) PDE4BPDE4APDE4CPDE4DALDH1A1

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-20080146614-A1 Therapeutic Agents ASTRAZENECA AB (SE) 2008-06-19 US disclosed
EP-1831177-A1 THERAPEUTIC AGENTS AstraZeneca AB (SE) 2007-09-12 EP disclosed
WO-2006067443-A1 THERAPEUTIC AGENTS ASTRAZENECA AB (SE) 2006-06-29 WO 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-20080146614-A1 Therapeutic Agents BDNF, NLN, GRIN2C PDE4B 1199/4885PDE4A 1789/4885PDE4C 2170/4885

“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.