SCHEMBL5650666

SCHEMBL5650666

Cc1ccc(CN)c(CNC(=O)Cc2c(C)ccn(NCc3cc(Cl)ccc3F)c2=O)c1

nearest known ligand 0.50

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
F2 P00734 15/20 0.50
P2RX7 Q99572 4/20 0.46
CYP3A4 P08684 1/20 0.46
ERCC1 P07992 1/20 0.41
ERCC4 Q92889 1/20 0.41
PRSS1 P07477 2/20 0.40

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
SCHEMBL5649670 0.96 P2RX7 (0.48) F2P2RX7CYP3A4ERCC1ERCC4
SCHEMBL5652019 0.90 P2RX7 (0.45) F2P2RX7CYP3A4
SCHEMBL5650513 0.89 F2 (0.48) F2P2RX7
SCHEMBL5646890 0.85 P2RX7 (0.48) F2P2RX7PRSS1
Hydrochloric Acid SCHEMBL5649636 0.85 F2 (0.61) F2P2RX7CYP3A4PRSS1
SCHEMBL5651491 0.84 F2 (0.47) F2P2RX7CYP3A4PRSS1
SCHEMBL5650353 0.84 F2 (0.46) F2P2RX7CYP3A4PRSS1
SCHEMBL5651838 0.84 P2RX7 (0.51) F2P2RX7
SCHEMBL5648686 0.84 F2 (0.47) F2P2RX7CYP3A4PRSS1
SCHEMBL5645368 0.83 P2RX7 (0.48) F2P2RX7CYP3A4PRSS1

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 2/4885P2RX7 2777/4885CYP3A4 267/4885

“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.