SCHEMBL5192807

SCHEMBL5192807

COC(=O)C1(NC(=O)OCC2c3ccccc3-c3ccccc32)CCN(C(=O)OC(C)(C)C)CC1

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 1/20 0.46
DPP8 Q6V1X1 1/20 0.41
DPP9 Q86TI2 1/20 0.41
KMT2A Q03164 2/20 0.40
KDM4E B2RXH2 1/20 0.39
PKM P14618 1/20 0.39
EPHX2 P34913 1/20 0.39
ALOX15 P16050 1/20 0.38
TSHR P16473 1/20 0.38
ATM Q13315 1/20 0.38
KDM1A O60341 1/20 0.38
GPR119 Q8TDV5 1/20 0.38

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
SCHEMBL31515070 1.00 BACE1 (0.46) BACE1DPP8DPP9KMT2AKDM4E
SCHEMBL1404239 0.91 BACE1 (0.48) BACE1DPP8DPP9KMT2AKDM4E
SCHEMBL30202258 0.91 BACE1 (0.48) BACE1DPP8DPP9KMT2AKDM4E
SCHEMBL12869622 0.88 BACE1 (0.45) BACE1DPP8DPP9KMT2AKDM4E
SCHEMBL14508508 0.88 BACE1 (0.45) BACE1DPP8DPP9KMT2AKDM4E
SCHEMBL2414478 0.87 BACE1 (0.41) BACE1DPP8DPP9KMT2AEPHX2
SCHEMBL4438430 0.86 KMT2A (0.46) BACE1DPP8DPP9KMT2AEPHX2
SCHEMBL12644793 0.85 KMT2A (0.52) DPP8DPP9KMT2AEPHX2
SCHEMBL2950721 0.85 BACE1 (0.48) BACE1DPP8DPP9KMT2AKDM4E
SCHEMBL22041869 0.85 BACE1 (0.49) BACE1DPP8DPP9KMT2AKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070249670-A1 Glycogen Phosphorylase Inhibitor Compounds and Pharmaceutical Compositions Thereof SMITHKLINE BEECHAM CORPORATION (US) 2007-10-25 US disclosed
EP-1812383-A1 GLYCOGEN PHOSPHORYLASE INHIBITOR COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS THEREOF Smithkline Beecham Corporation (US) 2007-08-01 EP disclosed
WO-2006052722-A1 GLYCOGEN PHOSPHORYLASE INHIBITOR COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS THEREOF SMITHKLINE BEECHAM CORPORATION (US) 2006-05-18 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-20070249670-A1 Glycogen Phosphorylase Inhibitor Compounds and Pharmaceutical Compositions Thereof PYGM, PYGL, GYS1 BACE1 795/4885DPP8 118/4885DPP9 85/4885

“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.