SCHEMBL831072

SCHEMBL831072

CC(=O)c1ccc(OCF)c(OCC2CC2)c1

nearest known ligand 0.54

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 18/20 0.54
PDE4A P27815 8/20 0.54
PDE4C Q08493 8/20 0.54
PDE4D Q08499 8/20 0.54
SLC6A9 P48067 1/20 0.45
ABCB11 O95342 1/20 0.44

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
SCHEMBL20463312 0.87 PDE4B (0.58) PDE4BPDE4APDE4CPDE4D
SCHEMBL3377412 0.87 PDE4B (0.62) PDE4BPDE4APDE4CPDE4D
SCHEMBL132715 0.85 PDE4B (0.74) PDE4BPDE4APDE4CPDE4DABCB11
SCHEMBL18374473 0.84 PDE4B (0.49) PDE4BPDE4APDE4CPDE4DSLC6A9
SCHEMBL20463367 0.84 SLC6A9 (0.53) PDE4BPDE4APDE4CPDE4DSLC6A9
SCHEMBL18374360 0.82 PDE4B (0.47) PDE4BPDE4APDE4CPDE4DSLC6A9
SCHEMBL15541722 0.81 PDE4B (0.46) PDE4BPDE4APDE4CPDE4DSLC6A9
SCHEMBL29384417 0.81 FFAR4 (0.47) PDE4BPDE4APDE4CPDE4DABCB11
SCHEMBL18374687 0.81 FFAR4 (0.47) PDE4BPDE4APDE4CPDE4DABCB11
SCHEMBL986726 0.81 PDE4B (0.46) PDE4BPDE4APDE4CPDE4DSLC6A9

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-8143262-B2 7-(3′,4′-Dialkoxyphenyl)[1,2,4]-triazolo[1,5-A]pyrimidine compounds, process for preparing thereof, and pharmaceutical composition for treating or preventing asthma, chronic obstructive pulmonary disease, arthritis, atopic dermatitis, tumor and degenerative brain diseases comprising the same KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2012-03-27 US disclosed
US-20100105704-A1 7-(3',4'-Dialkoxyphenyl)-[1,2,4]-Triazolo[1,5-A]Pyrimidine Compounds, Process for Preparing Thereof, and Pharmaceutical Composition for Treating or Preventing Asthma, Chronic Obstructive Pulmonary Disease, Arthritis, Atopic Dermatitis, Tumor and Degenerative Brain Diseases Comprising the Same KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2010-04-29 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-20100105704-A1 7-(3',4'-Dialkoxyphenyl)-[1,2,4]-Triazolo[1,5-A]Pyrimidine Compounds, Process for Preparing Thereof, and Pharmaceutical Composition for Treating or Preventing Asthma, Chronic Obstructive Pulmonary Disease, Arthritis, Atopic Dermatitis, Tumor and Degenerative Brain Diseases Comprising the Same TSLP, IL5, ADORA1 PDE4B 550/4885PDE4A 490/4885PDE4C 707/4885

“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.