SCHEMBL20021952

SCHEMBL20021952

COC(=O)c1ccc(OC2CCCC2)c(-c2ccc(C(=O)O)cc2)c1

nearest known ligand 0.64

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 10/20 0.64
PDE4B Q07343 9/20 0.64
PDE4C Q08493 9/20 0.64
PDE4D Q08499 9/20 0.64
PDE5A O76074 1/20 0.46
BCL9 O00512 2/20 0.46
CTNNB1 P35222 2/20 0.46
ALDH1A1 P00352 1/20 0.45
ATM Q13315 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
KMT2A Q03164 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
SCHEMBL20021946 0.91 PDE4D (0.54) PDE4APDE4BPDE4CPDE4DPDE5A
SCHEMBL20021950 0.83 SLC6A3 (0.50) PDE4APDE4BPDE4CPDE4DPDE5A
SCHEMBL20021945 0.83 PDE4A (0.60) PDE4APDE4BPDE4CPDE4DPDE5A
SCHEMBL27906536 0.81 PDE4D (0.54) PDE4APDE4BPDE4CPDE4DPDE5A
SCHEMBL20021951 0.79 PDE4B (0.54) PDE4APDE4BPDE4CPDE4DPDE5A
SCHEMBL5309884 0.79 PDE4D (0.67) PDE4APDE4BPDE4CPDE4DPDE5A
SCHEMBL7364684 0.79 PDE4D (0.60) PDE4APDE4BPDE4CPDE4DPDE5A
SCHEMBL5179644 0.79 PDE4A (0.58) PDE4APDE4BPDE4CPDE4D
SCHEMBL7444846 0.78 PDE4A (1.00) PDE4APDE4BPDE4CPDE4D
SCHEMBL8505957 0.78 PDE4D (0.55) PDE4APDE4BPDE4CPDE4DPDE5A

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 4232/4885PDE4B 3680/4885PDE4C 4067/4885

“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.