SCHEMBL5196554

SCHEMBL5196554

COC(=O)C1(NC(=O)c2cc3ccccc3cc2N)CCCCCCC1

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PYGL P06737 6/20 0.46
CYP2C9 P11712 1/20 0.46
CTSL P07711 2/20 0.43
CTSK P43235 2/20 0.43
IDO1 P14902 1/20 0.43
RAB9A P51151 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
POLB P06746 1/20 0.40
MAPT P10636 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
SCHEMBL5194411 1.00 PYGL (0.46) PYGLCYP2C9CTSLCTSKIDO1
SCHEMBL5197354 1.00 PYGL (0.46) PYGLCYP2C9CTSLCTSKIDO1
SCHEMBL5192234 1.00 PYGL (0.46) PYGLCYP2C9CTSLCTSKIDO1
SCHEMBL5196425 0.99 PYGL (0.45) PYGLCYP2C9CTSLCTSKIDO1
SCHEMBL5195375 0.94 IDO1 (0.46) PYGLCYP2C9IDO1RAB9AL3MBTL1
SCHEMBL5422464 0.90 IDO1 (0.41) PYGLCYP2C9CTSLCTSKIDO1
SCHEMBL5194915 0.88 IDO1 (0.41) PYGLCYP2C9IDO1RAB9AL3MBTL1
SCHEMBL5194226 0.88 PYGL (0.48) PYGLCYP2C9CTSLCTSKIDO1
SCHEMBL5192040 0.88 IDO1 (0.41) PYGLCYP2C9IDO1L3MBTL1
SCHEMBL27712399 0.86 PYGL (0.56) PYGLCYP2C9CTSLCTSKIDO1

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 PYGL 2/4885CYP2C9 2982/4885CTSL 2073/4885

“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.