SCHEMBL20021947

SCHEMBL20021947

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

nearest known ligand 0.62

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 11/20 0.53
PDE4D Q08499 11/20 0.53
PDE4A P27815 10/20 0.53
PDE4C Q08493 10/20 0.53
PDE5A O76074 1/20 0.53
KMT2A Q03164 1/20 0.52
NOTUM Q6P988 1/20 0.48
MAPK14 Q16539 1/20 0.47
ALDH1A1 P00352 1/20 0.46
POLB P06746 1/20 0.46

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
SCHEMBL31535406 0.97 PDE4B (0.50) PDE4BPDE4DPDE4APDE4CPDE5A
SCHEMBL8154363 0.97 PDE4B (0.50) PDE4BPDE4DPDE4APDE4CPDE5A
SCHEMBL16533471 0.94 NOTUM (0.50) PDE4BPDE4DPDE4APDE4CPDE5A
SCHEMBL27372082 0.87 PDE4D (0.52) PDE4BPDE4DPDE4APDE4CPDE5A
SCHEMBL2563365 0.87 KMT2A (0.47) PDE4BPDE4DPDE4APDE4CPDE5A
SCHEMBL5309884 0.84 PDE4D (0.67) PDE4BPDE4DPDE4APDE4CPDE5A
SCHEMBL7364684 0.84 PDE4D (0.60) PDE4BPDE4DPDE4APDE4CPDE5A
SCHEMBL20021951 0.84 PDE4B (0.54) PDE4BPDE4DPDE4APDE4CPDE5A
SCHEMBL2562290 0.84 KMT2A (0.59) PDE4BPDE4DPDE4APDE4CKMT2A
SCHEMBL27391576 0.83 NOTUM (0.46) PDE5AKMT2ANOTUMALDH1A1

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.