SCHEMBL5651601

SCHEMBL5651601

Cc1ccc(CN)c(CNC(=O)Cc2c(C)ccn(NCc3cccc4cccnc34)c2=O)c1

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
F2 P00734 13/20 0.47
ADORA2A P29274 3/20 0.38
ADORA1 P30542 3/20 0.38
P2RX7 Q99572 3/20 0.37
MEN1 O00255 1/20 0.37
GAA P10253 1/20 0.37
MAPT P10636 1/20 0.37
RECQL P46063 1/20 0.37
KMT2A Q03164 1/20 0.37

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
SCHEMBL5647797 0.92 F2 (0.45) F2ADORA2AADORA1P2RX7
SCHEMBL5651604 0.84 KLKB1 (0.43) F2ADORA2AADORA1
SCHEMBL5652332 0.82 F2 (0.51) F2P2RX7
SCHEMBL5969242 0.81 SLC22A12 (0.45) F2ADORA2AADORA1
SCHEMBL5650713 0.80 F2 (0.49) F2P2RX7
SCHEMBL5647953 0.79 F2 (0.47) F2P2RX7
SCHEMBL5649688 0.79 F2 (0.54) F2P2RX7
SCHEMBL5650666 0.79 F2 (0.50) F2P2RX7
SCHEMBL5650002 0.78 F2 (0.64) F2P2RX7
SCHEMBL5650692 0.78 F2 (0.51) F2

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 4 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
CN-1918124-A New pyridin-2-one compounds useful as inhibitors of thrombin ASTRAZENECA AB (SE) 2007-02-21 CN 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 2/4885ADORA2A 890/4885ADORA1 575/4885

“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.