SCHEMBL2908852

SCHEMBL2908852

COc1cc(C)c(N(Cc2cccnc2)c2ccc(C(=O)O)cc2)cc1OC1CCCC1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 10/20 0.50
PDE4D Q08499 9/20 0.50
PDE4B Q07343 7/20 0.50
PDE4C Q08493 7/20 0.50
LPAR1 Q92633 2/20 0.44
LPAR5 Q9H1C0 2/20 0.44
TP53 P04637 1/20 0.40
MAPT P10636 1/20 0.40
EPHX2 P34913 1/20 0.40
USP2 O75604 1/20 0.39
ALDH1A1 P00352 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
GAA P10253 1/20 0.39
HTT P42858 1/20 0.39

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
SCHEMBL2902044 0.92 PDE4A (0.49) PDE4APDE4DPDE4BPDE4CLPAR1
SCHEMBL2907346 0.91 PDE4A (0.49) PDE4APDE4DPDE4BPDE4CLPAR1
SCHEMBL2908823 0.91 PDE4A (0.49) PDE4APDE4DPDE4BPDE4CLPAR1
SCHEMBL2905239 0.90 PDE4A (0.54) PDE4APDE4DPDE4BPDE4CNPSR1
SCHEMBL3121037 0.88 PDE4A (0.53) PDE4APDE4DPDE4BPDE4CLPAR1
SCHEMBL3130998 0.88 PDE4A (0.53) PDE4APDE4DPDE4BPDE4CLPAR1
SCHEMBL1157624 0.88 PDE4A (0.57) PDE4APDE4DPDE4BPDE4CLPAR1
SCHEMBL4194607 0.87 PDE4A (0.56) PDE4APDE4DPDE4BPDE4CLPAR1
SCHEMBL4198463 0.86 PDE4A (0.55) PDE4APDE4DPDE4BPDE4CLPAR1
SCHEMBL3199104 0.83 PDE4A (0.52) 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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1692109-B1 PHOSPHODIESTERASE 4 INHIBITORS, INCLUDING N-SUBSTITUTED DIARYLAMINE ANALOGS MEMORY PHARM CORP (US) 2010-08-18 EP claimed
US-20050222207-A1 Phosphodiesterase 4 inhibitors, including N-substituted diarylamine analogs MEMORY PHARMACEUTICAL CORPORATION 2005-10-06 US claimed
EP-1692109-B1 PHOSPHODIESTERASE 4 INHIBITORS, INCLUDING N-SUBSTITUTED DIARYLAMINE ANALOGS MEMORY PHARM CORP (US) 2010-08-18 EP disclosed
EP-1692109-A2 PHOSPHODIESTERASE 4 INHIBITORS, INCLUDING N-SUBSTITUTED DIARYLAMINE ANALOGS Memory Pharmaceuticals Corporation (US) 2006-08-23 EP disclosed
US-20050222207-A1 Phosphodiesterase 4 inhibitors, including N-substituted diarylamine analogs MEMORY PHARMACEUTICAL CORPORATION 2005-10-06 US disclosed
WO-2005061458-A2 PHOSPHODIESTERASE 4 INHIBITORS, INCLUDING N-SUBSTITUTED DIARYLAMINE ANALOGS MEMORY PHARMACEUTICALS CORPORATION (US) 2005-07-07 WO disclosed
WO-2005061458-A2 PHOSPHODIESTERASE 4 INHIBITORS, INCLUDING N-SUBSTITUTED DIARYLAMINE ANALOGS MEMORY PHARMACEUTICALS CORPORATION (US) 2005-07-07 WO 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-20050222207-A1 Phosphodiesterase 4 inhibitors, including N-substituted diarylamine analogs PDE4A, PDE4B, PDE3B PDE4A 1/4885PDE4D 6/4885PDE4B 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.