SCHEMBL20021951

SCHEMBL20021951

COC(=O)c1ccc(OC2CCCC2)c(C)c1

nearest known ligand 0.64

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 10/20 0.54
PDE4D Q08499 10/20 0.54
PDE4A P27815 9/20 0.54
PDE4C Q08493 9/20 0.54
PDE5A O76074 2/20 0.51
EPHX2 P34913 1/20 0.50
PDE1A P54750 1/20 0.49
PDE1B Q01064 1/20 0.49
PDE1C Q14123 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.48
MAPK14 Q16539 1/20 0.48
HRH3 Q9Y5N1 1/20 0.47
POLB P06746 1/20 0.47

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
SCHEMBL7364684 0.85 PDE4D (0.60) PDE4BPDE4DPDE4APDE4CPDE5A
SCHEMBL5309884 0.85 PDE4D (0.67) PDE4BPDE4DPDE4APDE4CPDE5A
SCHEMBL15030530 0.85 PDE4B (0.50) PDE4BPDE4DPDE4APDE4CPDE5A
SCHEMBL28047777 0.85 PDE4B (0.60) PDE4BPDE4DPDE4APDE4CPDE5A
SCHEMBL12492072 0.84 PDE4B (0.47) PDE4BPDE4DPDE4APDE4CHRH3
SCHEMBL20021947 0.84 PDE4B (0.53) PDE4BPDE4DPDE4APDE4CPDE5A
SCHEMBL15904302 0.84 PDE4D (0.55) PDE4BPDE4DPDE4APDE4CPDE5A
SCHEMBL8505957 0.84 PDE4D (0.55) PDE4BPDE4DPDE4APDE4CPDE5A
SCHEMBL8503889 0.83 PDE4D (0.54) PDE4BPDE4DPDE4APDE4CPDE5A
SCHEMBL16544973 0.82 MAPT (0.59) PDE4BPDE4DPDE4APDE4CPDE5A

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-20180092866-A1 SUBSTITUTED N-([1,1'-BIPHENYL]-3-YL)-[1,1'-BIPHENYL]-3-CARBOXAMIDE ANALOGS AS INHIBITORS FOR BETA-CATENIN/B-CELL LYMPHOMA 9 INTERACTIONS THE GOVERNMENT OF THE UNITED STATES, AS REPRESENTED BY THE SECRETARY OF THE ARMY 2018-04-05 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-20180092866-A1 SUBSTITUTED N-([1,1'-BIPHENYL]-3-YL)-[1,1'-BIPHENYL]-3-CARBOXAMIDE ANALOGS AS INHIBITORS FOR BETA-CATENIN/B-CELL LYMPHOMA 9 INTERACTIONS BCL9, BCL9L, BCL3 PDE4B 3680/4885PDE4D 3631/4885PDE4A 4232/4885

“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.