SCHEMBL5844299

SCHEMBL5844299

CCCc1c(OCc2cccc(-c3cc(C(C)CS(C)(=O)=O)cc4cccnc34)c2)ccc(C(C)=O)c1O

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CYSLTR1 Q9Y271 12/20 0.47
GRM2 Q14416 8/20 0.47
CYSLTR2 Q9NS75 4/20 0.42
PDE4A P27815 5/20 0.40
PDE4B Q07343 5/20 0.40
PDE4C Q08493 5/20 0.40
PDE4D Q08499 5/20 0.40
CYP2C9 P11712 3/20 0.39

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
SCHEMBL5844308 0.89 CYSLTR1 (0.48) CYSLTR1GRM2CYSLTR2PDE4APDE4B
SCHEMBL4035673 0.84 CYP2C9 (0.58) PDE4APDE4BPDE4CPDE4DCYP2C9
SCHEMBL6603007 0.75 PDE4A (0.48) PDE4APDE4BPDE4CPDE4DCYP2C9
SCHEMBL5778745 0.74 PDE4A (0.52) PDE4APDE4BPDE4CPDE4DCYP2C9
SCHEMBL5775461 0.73 SLC40A1 (0.48) PDE4APDE4BPDE4CPDE4DCYP2C9
SCHEMBL5776441 0.71 CYP2C9 (0.47) PDE4APDE4BPDE4CPDE4DCYP2C9
SCHEMBL5777013 0.71 PDE4A (0.56) PDE4APDE4BPDE4CPDE4DCYP2C9
SCHEMBL2893372 0.71 CYSLTR1 (0.60) CYSLTR1GRM2CYSLTR2CYP2C9
SCHEMBL4937170 0.70 CYSLTR1 (0.52) CYSLTR1GRM2CYSLTR2CYP2C9
SCHEMBL5779532 0.70 PDE4A (0.45) PDE4APDE4BPDE4CPDE4DCYP2C9

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-7144896-B2 Hetero-bridge substituted 8-arylquinoline pde4 inhibitors MERCK FROSST CANADA LTD. (CA) 2006-12-05 US disclosed
US-20050245513-A1 Hetero-bridge substituted 8-arylquinoline pde4 inhibitors MERCK FROSST CANADA LTD. (CA) 2005-11-03 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-20050245513-A1 Hetero-bridge substituted 8-arylquinoline pde4 inhibitors PDE4A, PDE4B, PDE4C CYSLTR1 3931/4885GRM2 3952/4885CYSLTR2 3662/4885

“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.