SCHEMBL5746063

SCHEMBL5746063

CSc1cccc(Oc2ncc(F)cc2C(=O)NC2CCN(C(=O)c3cccnc3)CC2)c1

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 16/20 0.47
PDE4A P27815 1/20 0.46
PDE4D Q08499 1/20 0.46
EPHX2 P34913 2/20 0.45
EPHX1 P07099 1/20 0.42
IRAK4 Q9NWZ3 1/20 0.42
PARP1 P09874 1/20 0.42

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
SCHEMBL5747650 0.94 PDE4B (0.47) PDE4BPDE4APDE4D
SCHEMBL5746109 0.93 PDE4B (0.48) PDE4BPDE4APDE4D
SCHEMBL5747038 0.93 PDE4B (0.47) PDE4BPDE4APDE4D
SCHEMBL5744498 0.88 PDE4B (0.47) PDE4BPDE4APDE4D
SCHEMBL5747017 0.88 PDE4B (0.50) PDE4BPDE4APDE4D
SCHEMBL5744719 0.88 PDE4B (0.48) PDE4BPDE4APDE4DEPHX2
SCHEMBL5744925 0.87 PDE4B (0.49) PDE4BPDE4APDE4D
SCHEMBL5744692 0.87 LMNA (0.49) PDE4BPDE4APDE4D
SCHEMBL5745355 0.87 PDE4B (0.52) PDE4BPDE4APDE4D
SCHEMBL5745954 0.86 PDE4B (0.56) PDE4BPDE4APDE4D

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1651635-A1 NICOTINAMIDE DERIVATIVES USEFUL AS PDE4 INHIBITORS Pfizer Limited (GB) 2006-05-03 EP disclosed
WO-2005009989-A1 NICOTINAMIDE DERIVATIVES USEFUL AS PDE4 INHIBITORS PFIZER LIMITED (GB) 2005-02-03 WO disclosed
WO-2005009989-A1 NICOTINAMIDE DERIVATIVES USEFUL AS PDE4 INHIBITORS PFIZER LIMITED (GB) 2005-02-03 WO disclosed
US-20050020587-A1 Nicotinamide derivatives useful as PDE4 inhibitors PFIZER INC 2005-01-27 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-20050020587-A1 Nicotinamide derivatives useful as PDE4 inhibitors PDE4A, PDE4B, PDE4D PDE4B 2/4885PDE4A 1/4885PDE4D 3/4885

“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.