SCHEMBL5652704

SCHEMBL5652704

CCNC(=O)COc1ccc(Cl)cc1CNC(=O)Cc1c(C)ccn(NCc2ccc3c(c2)CCO3)c1=O

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
F2 P00734 13/20 0.45
PRSS1 P07477 6/20 0.45
PRSS2 P07478 6/20 0.45
PRSS3 P35030 6/20 0.45
RAB9A P51151 1/20 0.37
ANO1 Q5XXA6 2/20 0.36
ANO2 Q9NQ90 1/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
BCHE P06276 1/20 0.36
ACHE P22303 1/20 0.36
TRPV1 Q8NER1 1/20 0.35
LMNA P02545 1/20 0.35

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
SCHEMBL5651509 0.85 F2 (0.54) F2PRSS1PRSS2PRSS3ANO1
SCHEMBL5652015 0.84 F2 (0.48) F2PRSS1PRSS2PRSS3ANO1
SCHEMBL5645845 0.84 F2 (0.48) F2PRSS1PRSS2PRSS3ANO1
SCHEMBL5650083 0.83 F2 (0.48) F2PRSS1PRSS2PRSS3ANO1
SCHEMBL5650131 0.82 F2 (0.52) F2PRSS1PRSS2PRSS3ANO1
SCHEMBL5650956 0.82 F2 (0.46) F2PRSS1PRSS2PRSS3ANO1
SCHEMBL5651304 0.82 F2 (0.50) F2PRSS1PRSS2PRSS3ANO1
SCHEMBL5652489 0.81 F2 (0.52) F2PRSS1PRSS2PRSS3ANO1
SCHEMBL5650742 0.81 F2 (0.51) F2PRSS1PRSS2PRSS3ANO1
SCHEMBL5968944 0.81 F2 (0.42) F2PRSS1PRSS2PRSS3RAB9A

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 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.