SCHEMBL5647486

SCHEMBL5647486

CCNC(=O)COc1ccc(Cl)cc1CNC(=O)Cc1c(C)ccn(NCc2c(C)noc2C)c1=O

nearest known ligand 0.51

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 15/20 0.51
F2 P00734 4/20 0.50
PRSS1 P07477 4/20 0.50
PRSS2 P07478 4/20 0.50
PRSS3 P35030 4/20 0.50
LMNA P02545 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41

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
SCHEMBL5649573 0.90 F2 (0.47) P2RX7F2PRSS1PRSS2PRSS3
SCHEMBL5649805 0.90 F2 (0.47) P2RX7F2PRSS1PRSS2PRSS3
SCHEMBL5650866 0.87 F2 (0.51) P2RX7F2PRSS1PRSS2PRSS3
SCHEMBL5650131 0.86 F2 (0.52) P2RX7F2PRSS1PRSS2PRSS3
SCHEMBL5651304 0.85 F2 (0.50) P2RX7F2PRSS1PRSS2PRSS3
SCHEMBL5651509 0.85 F2 (0.54) P2RX7F2PRSS1PRSS2PRSS3
SCHEMBL5647971 0.85 F2 (0.50) P2RX7F2PRSS1PRSS2PRSS3
SCHEMBL5652015 0.85 F2 (0.48) P2RX7F2PRSS1PRSS2PRSS3
SCHEMBL5652489 0.84 F2 (0.52) P2RX7F2PRSS1PRSS2PRSS3
SCHEMBL5647938 0.84 F2 (0.49) P2RX7F2PRSS1PRSS2PRSS3

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 1 patent. 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

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 P2RX7 2777/4885F2 2/4885PRSS1 20/4885

“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.