SCHEMBL5651637

SCHEMBL5651637

CCNC(=O)COc1ccc(Cl)cc1CNC(=O)Cc1c(C)ccn(NCc2c(C)nn(C)c2N2CCOCC2)c1=O

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
F2 P00734 4/20 0.46
PRSS1 P07477 4/20 0.46
PRSS2 P07478 4/20 0.46
PRSS3 P35030 4/20 0.46
KDM4E B2RXH2 1/20 0.41
LMNA P02545 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
NPSR1 Q6W5P4 1/20 0.40
TSHR P16473 2/20 0.39
NPC1 O15118 1/20 0.39
MAPT P10636 1/20 0.39
MAPK1 P28482 1/20 0.39
P2RX7 Q99572 3/20 0.38
MCHR1 Q99705 1/20 0.37
THRB P10828 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36

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
SCHEMBL5650866 0.88 F2 (0.51) F2PRSS1PRSS2PRSS3LMNA
SCHEMBL5651281 0.88 P2RX7 (0.42) F2PRSS1PRSS2PRSS3P2RX7
SCHEMBL5650557 0.86 TSHR (0.48) F2PRSS1PRSS2PRSS3KDM4E
SCHEMBL5647344 0.86 F2 (0.45) F2PRSS1PRSS2PRSS3KDM4E
SCHEMBL5647486 0.83 P2RX7 (0.51) F2PRSS1PRSS2PRSS3LMNA
SCHEMBL5652203 0.82 F2 (0.52) F2PRSS1PRSS2PRSS3LMNA
SCHEMBL5650131 0.81 F2 (0.52) F2PRSS1PRSS2PRSS3LMNA
SCHEMBL5647938 0.81 F2 (0.49) F2PRSS1PRSS2PRSS3LMNA
SCHEMBL5651876 0.81 F2 (0.47) F2PRSS1PRSS2PRSS3KDM4E
SCHEMBL5648385 0.81 F2 (0.51) F2PRSS1PRSS2PRSS3KDM4E

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 2/4885PRSS1 20/4885PRSS2 17/4885

“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.