SCHEMBL4923610

SCHEMBL4923610

CC(C)(C)OC(=O)C(c1ccccc1F)C(N)CC(=O)O

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
AAK1 Q2M2I8 1/20 0.38
EEF2K O00418 3/20 0.37
CTSA P10619 7/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
CYP2C19 P33261 1/20 0.36
HIF1A Q16665 1/20 0.36
CTSS P25774 1/20 0.35
CTSK P43235 1/20 0.35
IDO1 P14902 1/20 0.35
TDO2 P48775 1/20 0.35
GAA P10253 1/20 0.35
CNR2 P34972 1/20 0.35
LTA4H P09960 1/20 0.34

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
SCHEMBL3453796 0.83 DPP4 (0.37) AAK1LTA4H
SCHEMBL6246072 0.82 CYP2C19 (0.39) AAK1EEF2KCTSAMEN1KMT2A
SCHEMBL1519634 0.80 APP (0.44) MEN1KMT2ACYP2C19GAA
SCHEMBL1519829 0.79 FFAR1 (0.40) AAK1MEN1KMT2ACYP2C19CTSS
SCHEMBL27506659 0.76 IDO1 (0.39) AAK1MEN1KMT2ACTSSCTSK
SCHEMBL27477423 0.76 IDO1 (0.39) AAK1MEN1KMT2ACTSSCTSK
SCHEMBL1521461 0.75 LMNA (0.40) EEF2KCTSACYP2C19IDO1GAA
SCHEMBL1519893 0.75 FFAR1 (0.39) CYP2C19
SCHEMBL1519753 0.74 FFAR1 (0.44) EEF2K
SCHEMBL15268637 0.74 ROCK2 (0.40) AAK1MEN1KMT2ACTSSCTSK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080275086-A1 Dpp-Iv Inhibitors SANTHERA PHARMACEUTICALS (SCHWEIZ) AG (CH) 2008-11-06 US disclosed
EP-1858846-A1 DPP-IV INHIBITORS Santhera Pharmaceuticals (Schweiz) GmbH (CH) 2007-11-28 EP disclosed
US-20070265301-A1 Dpp-IV Inhibitors SANTHERA PHARMACEUTICALS (SCHWEIZ) AG (CH) 2007-11-15 US disclosed
EP-1828138-A1 DPP-IV INHIBITORS Santhera Pharmaceuticals (Schweiz) AG (CH) 2007-09-05 EP disclosed
US-20070197522-A1 Dpp-iv inhibitors SANTHERA PHARMACEUTICALS (SCHWEIZ) GMBH (CH) 2007-08-23 US disclosed
CN-1980892-A Dpp-IV inhibitors SANTHERA PHARMACEUTICALS CH (CH) 2007-06-13 CN disclosed
EP-1758861-A1 DPP-IV INHIBITORS Santhera Pharmaceuticals (Schweiz) AG (CH) 2007-03-07 EP disclosed
WO-2006097175-A1 DPP-IV INHIBITORS SANTHERA PHARMACEUTICALS (SCHWEIZ) AG (CH) 2006-09-21 WO disclosed
EP-1702916-A1 DPP-IV inhibitors Santhera Pharmaceuticals (Schweiz) GmbH (CH) 2006-09-20 EP disclosed
EP-1604989-A1 DPP-IV inhibitors Santhera Pharmaceuticals (Deutschland) Aktiengesellschaft (DE) 2005-12-14 EP disclosed
WO-2005113510-A1 DPP-IV INHIBITORS SANTHERA PHARMACEUTICALS (SCHWEIZ) AG (CH) 2005-12-01 WO disclosed
EP-1598341-A1 DPP-IV inhibitors Santhera Pharmaceuticals (Deutschland) Aktiengesellschaft (DE) 2005-11-23 EP disclosed
WO-2005095343-A1 DPP-IV INHIBITORS SANTHERA PHARMACEUTICALS (SCHWEIZ) GMBH (CH) 2005-10-13 WO disclosed
WO-2005056013-A1 DPP-IV INHIBITORS SANTHERA PHARMACEUTICALS (SCHWEIZ) GMBH (CH) 2005-06-23 WO disclosed
EP-1541148-A1 DPP-IV INHIBITORS Graffinity Pharmaceuticals Aktiengesellschaft (DE) 2005-06-15 EP 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 (3 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-20070197522-A1 Dpp-iv inhibitors DPP7, DPP4, DPP3 AAK1 4059/4885EEF2K 4035/4885CTSA 1434/4885
US-20080275086-A1 Dpp-Iv Inhibitors DPP4, DPP7, DPP3 AAK1 3326/4885EEF2K 3428/4885CTSA 1501/4885
US-20070265301-A1 Dpp-IV Inhibitors DPP4, DPP8, DPP7 AAK1 2369/4885EEF2K 4354/4885CTSA 1687/4885

“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.