SCHEMBL2902489

SCHEMBL2902489

COc1ccc(N(Cc2cccnc2)c2cccc(C(=O)O)c2)nc1O[C@@H]1CCOC1

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PDE4D Q08499 11/20 0.44
PDE4A P27815 7/20 0.44
PDE4B Q07343 7/20 0.44
PDE4C Q08493 7/20 0.44
GRM2 Q14416 1/20 0.38
TP53 P04637 1/20 0.38
MAPT P10636 1/20 0.38
FGFR3 P22607 1/20 0.38
KDM4E B2RXH2 1/20 0.37
MEN1 O00255 1/20 0.37
ALDH1A1 P00352 1/20 0.37
GLA P06280 1/20 0.37
GAA P10253 1/20 0.37
HPGD P15428 1/20 0.37
KMT2A Q03164 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37

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
SCHEMBL2910468 1.00 PDE4D (0.44) PDE4DPDE4APDE4BPDE4CGRM2
SCHEMBL2907956 0.91 PDE4A (0.45) PDE4DPDE4APDE4BPDE4CGRM2
SCHEMBL2905268 0.91 PDE4A (0.47) PDE4DPDE4APDE4BPDE4CGRM2
SCHEMBL2908190 0.89 PDE4D (0.42) PDE4DPDE4APDE4BPDE4CTP53
SCHEMBL1157563 0.88 PDE4D (0.54) PDE4DPDE4APDE4BPDE4C
SCHEMBL2904815 0.87 PDE4B (0.38) PDE4DPDE4APDE4BPDE4CTP53
SCHEMBL2910346 0.87 GRM2 (0.45) PDE4DPDE4APDE4BPDE4CGRM2
SCHEMBL8285678 0.85 GRM2 (0.38) PDE4DPDE4APDE4BPDE4CGRM2
SCHEMBL2908377 0.85 LTC4S (0.42) PDE4DPDE4APDE4BPDE4CGRM2
SCHEMBL2908741 0.83 GRM2 (0.44) PDE4DPDE4APDE4BPDE4CGRM2

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 2 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 disclosed
US-20050222207-A1 Phosphodiesterase 4 inhibitors, including N-substituted diarylamine analogs MEMORY PHARMACEUTICAL CORPORATION 2005-10-06 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-20050222207-A1 Phosphodiesterase 4 inhibitors, including N-substituted diarylamine analogs PDE4A, PDE4B, PDE3B PDE4D 6/4885PDE4A 1/4885PDE4B 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.