SCHEMBL20021945

SCHEMBL20021945

O=C(O)c1ccc(OC2CCCC2)c(-c2ccccc2)c1

nearest known ligand 0.60

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 10/20 0.60
PDE4D Q08499 10/20 0.60
PDE4B Q07343 9/20 0.60
PDE4C Q08493 9/20 0.60
HRH1 P35367 1/20 0.47
BCL9 O00512 2/20 0.44
CTNNB1 P35222 2/20 0.44
PDE5A O76074 1/20 0.43
PTPRC P08575 2/20 0.43

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
SCHEMBL5179635 0.89 PDE4D (0.56) PDE4APDE4DPDE4BPDE4CHRH1
SCHEMBL20021946 0.87 PDE4D (0.54) PDE4APDE4DPDE4BPDE4CPDE5A
SCHEMBL5179644 0.84 PDE4A (0.58) PDE4APDE4DPDE4BPDE4CHRH1
SCHEMBL20021948 0.83 PDE4A (0.63) PDE4APDE4DPDE4BPDE4CBCL9
SCHEMBL20021962 0.83 CTNNB1 (0.58) PDE4APDE4DPDE4BPDE4CBCL9
SCHEMBL20021952 0.83 PDE4A (0.64) PDE4APDE4DPDE4BPDE4CBCL9
SCHEMBL23685090 0.81 KMO (0.52) PDE4APDE4DPDE4BPDE4C
SCHEMBL13332346 0.78 PDE4A (0.54) PDE4APDE4DPDE4BPDE4C
SCHEMBL27522110 0.78 HRH1 (0.71) PDE4APDE4DPDE4BPDE4CHRH1
SCHEMBL20021949 0.78 HRH1 (0.50) PDE4APDE4DPDE4BPDE4CHRH1

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 PDE4A 4232/4885PDE4D 3631/4885PDE4B 3680/4885

“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.