SCHEMBL5649641

SCHEMBL5649641

COC(=O)Cc1c(C)ccn(NCCc2ccccc2)c1=O

nearest known ligand 0.58

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
F2 P00734 8/20 0.58
L3MBTL1 Q9Y468 1/20 0.53
CA12 O43570 1/20 0.42
CA7 P43166 1/20 0.42
CA9 Q16790 1/20 0.42
CA14 Q9ULX7 1/20 0.42
IDH1 O75874 1/20 0.42
KDM4E B2RXH2 2/20 0.39
USP2 O75604 1/20 0.39
GAA P10253 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
TP53 P04637 1/20 0.39
MAPT P10636 1/20 0.39
ALDH1A1 P00352 1/20 0.38
EGFR P00533 1/20 0.38
TAAR1 Q96RJ0 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
SCHEMBL5652515 0.87 F2 (0.59) F2L3MBTL1KDM4EUSP2GAA
SCHEMBL5651878 0.84 KDM4E (0.45) F2KDM4EMEN1KMT2AMAPT
SCHEMBL3166480 0.81 L3MBTL1 (0.78) F2L3MBTL1IDH1KDM4EUSP2
SCHEMBL5651411 0.80 F2 (0.61) F2L3MBTL1IDH1
SCHEMBL5650269 0.80 F2 (0.59) F2L3MBTL1KDM4EGAAMEN1
SCHEMBL3175227 0.79 L3MBTL1 (0.59) L3MBTL1IDH1KDM4EGAAMEN1
SCHEMBL5647154 0.78 F2 (0.49) F2L3MBTL1CA12CA9GAA
SCHEMBL5649784 0.77 F2 (0.59) F2L3MBTL1KDM4EUSP2GAA
SCHEMBL5649003 0.77 F2 (0.41) F2L3MBTL1KDM4EGAAMEN1
SCHEMBL27669480 0.76 L3MBTL1 (0.41) F2L3MBTL1IDH1KDM4EUSP2

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-20070161643-A1 Pyridin-2-one compounds useful as inhibitors of thrombin ASTRAZENECA AB (SE) 2007-07-12 US disclosed
EP-1713774-A1 NEW PYRIDIN-2-ONE COMPOUNDS USEFUL AS INHIBITORS OF THROMBIN AstraZeneca AB (SE) 2006-10-25 EP disclosed
WO-2005075424-A1 NEW PYRIDIN-2-ONE COMPOUNDS USEFUL AS INHIBITORS OF THROMBIN ASTRAZENECA AB (SE) 2005-08-18 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-20070161643-A1 Pyridin-2-one compounds useful as inhibitors of thrombin PLG, F2, PLAT F2 2/4885L3MBTL1 171/4885CA12 3939/4885

“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.