SCHEMBL2908090

SCHEMBL2908090

COC(=O)c1ccc(N(Cc2cccnc2)c2cccc(C(=O)OC(C)(C)C)c2)cc1OC

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDK1 Q15118 6/20 0.42
RECQL P46063 1/20 0.42
KDM4E B2RXH2 1/20 0.41
MMP1 P03956 1/20 0.41
MMP9 P14780 1/20 0.41
MMP13 P45452 1/20 0.41
ADAM17 P78536 1/20 0.41
GRM2 Q14416 2/20 0.40
CYP1A2 P05177 2/20 0.40
CYP3A4 P08684 2/20 0.40
KMT2A Q03164 1/20 0.40
TSHR P16473 1/20 0.40
BLM P54132 1/20 0.40
L3MBTL1 Q9Y468 2/20 0.39
CYP2C19 P33261 1/20 0.39
USP2 O75604 1/20 0.39
ALDH1A1 P00352 1/20 0.39
NPSR1 Q6W5P4 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
SCHEMBL2910936 0.93 PDK1 (0.41) PDK1RECQLGRM2CYP1A2CYP3A4
SCHEMBL2908204 0.92 MKNK1 (0.48) PDK1RECQLGRM2CYP1A2CYP3A4
SCHEMBL3205165 0.87 NPC1 (0.43) PDK1KDM4EGRM2KMT2AL3MBTL1
SCHEMBL3122799 0.85 PDE4B (0.42) KDM4EGRM2KMT2AL3MBTL1USP2
SCHEMBL2901912 0.85 KDM4E (0.35) KDM4EKMT2ATSHRL3MBTL1ALDH1A1
SCHEMBL2903452 0.84 PDK1 (0.45) PDK1RECQLMMP1MMP9MMP13
SCHEMBL2910342 0.83 HTT (0.41) GRM2KMT2AL3MBTL1USP2ALDH1A1
SCHEMBL4193004 0.83 PDE4A (0.52) GRM2
SCHEMBL4196553 0.82 GRM2 (0.40) GRM2KMT2A
SCHEMBL3131249 0.82 ALDH1A1 (0.45) KDM4ECYP1A2CYP3A4KMT2ATSHR

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 PDK1 935/4885RECQL 137/4885KDM4E 252/4885

“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.