SCHEMBL17409306

SCHEMBL17409306

COc1c(C(C)(C)C)cc2c(c1-c1ccccc1)C=C(C)C2[SiH3]

nearest known ligand 0.37

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 5/20 0.37
PDE4A P27815 4/20 0.37
PDE4C Q08493 4/20 0.37
PDE4D Q08499 4/20 0.37
TNFRSF1A P19438 1/20 0.33
ALDH1A1 P00352 1/20 0.30
CYP3A4 P08684 1/20 0.30

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
SCHEMBL17286312 0.86 PDE4B (0.38) PDE4BPDE4APDE4CPDE4DTNFRSF1A
SCHEMBL15700813 0.85 PDE4B (0.35) PDE4BPDE4APDE4CPDE4DTNFRSF1A
SCHEMBL14645969 0.85 PDE4B (0.37) PDE4BPDE4APDE4CPDE4DTNFRSF1A
SCHEMBL17409131 0.85
SCHEMBL28110282 0.84 PDE4B (0.35) PDE4BPDE4APDE4CPDE4DTNFRSF1A
Hydrochloric Acid SCHEMBL22653349 0.84 PDE4B (0.36) PDE4BPDE4APDE4CPDE4DTNFRSF1A
Hydrochloric Acid SCHEMBL16286923 0.84 PDE4B (0.36) PDE4BPDE4APDE4CPDE4DTNFRSF1A
SCHEMBL3736095 0.83 PDE4B (0.35) PDE4BPDE4APDE4CPDE4DTNFRSF1A
Hydrochloric Acid SCHEMBL27905100 0.83 PDE4B (0.35) PDE4BPDE4APDE4CPDE4DTNFRSF1A
SCHEMBL17783835 0.82 PDE4B (0.35) PDE4BPDE4APDE4CPDE4DTNFRSF1A

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-9469699-B2 Catalysts BOREALIS AG (AT) 2016-10-18 US disclosed
US-20160002369-A1 CATALYSTS BOREALIS AG (AT) 2016-01-07 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-20160002369-A1 CATALYSTS SIGMAR1, SFN, AP3S1 PDE4B 4863/4885PDE4A 4877/4885PDE4C 4864/4885

“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.