SCHEMBL3199104

SCHEMBL3199104

COC(=O)c1ccc(N(Cc2cccnc2)c2ccc(OC)c(OC3CCCC3)c2)c(C)c1

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 11/20 0.52
PDE4D Q08499 10/20 0.52
PDE4B Q07343 10/20 0.52
PDE4C Q08493 9/20 0.52
EPHX2 P34913 1/20 0.43
PDE5A O76074 2/20 0.42
USP2 O75604 1/20 0.42
ALDH1A1 P00352 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
GAA P10253 1/20 0.41
HTT P42858 1/20 0.41
PDE1A P54750 1/20 0.41
PDE1B Q01064 1/20 0.41
PDE1C Q14123 1/20 0.41

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
SCHEMBL3130998 0.93 PDE4A (0.53) PDE4APDE4DPDE4BPDE4CEPHX2
SCHEMBL3131295 0.91 PDE4A (0.44) PDE4APDE4DPDE4BPDE4CEPHX2
SCHEMBL4194617 0.88 PDE4A (0.55) PDE4APDE4DPDE4BPDE4CPDE5A
SCHEMBL1157312 0.87 PDE4A (0.55) PDE4APDE4DPDE4BPDE4CGAA
SCHEMBL3126414 0.87 PDE4B (0.51) PDE4APDE4DPDE4BPDE4CEPHX2
SCHEMBL3121037 0.86 PDE4A (0.53) PDE4APDE4DPDE4BPDE4CEPHX2
SCHEMBL1157778 0.85 PDE4A (0.57) PDE4APDE4DPDE4BPDE4CEPHX2
SCHEMBL1157639 0.84 PDE4B (0.54) PDE4APDE4DPDE4BPDE4CEPHX2
SCHEMBL1157624 0.84 PDE4A (0.57) PDE4APDE4DPDE4BPDE4CUSP2
SCHEMBL4195860 0.83 PDE4A (0.55) PDE4APDE4DPDE4BPDE4CEPHX2

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-20100029689-A1 PHOSPHODIESTERASE 4 INHIBITORS MEMORY PHARMACEUTICALS CORPORATION (US) 2010-02-04 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-20100029689-A1 PHOSPHODIESTERASE 4 INHIBITORS PDE4A, PDE4B, PDE3B PDE4A 1/4885PDE4D 9/4885PDE4B 2/4885

“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.