SCHEMBL6963877

SCHEMBL6963877

O=C(O)Cc1nc(NCC(F)(F)c2ccccn2)c(=O)[nH]c1Cl

nearest known ligand 0.47

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
F2 P00734 20/20 0.47
PRSS1 P07477 2/20 0.42
PRSS2 P07478 1/20 0.40
PRSS3 P35030 1/20 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
SCHEMBL7527900 0.87 F2 (0.42) F2PRSS1PRSS2PRSS3
SCHEMBL7409413 0.86 CNR1 (0.39) F2PRSS1PRSS2PRSS3
SCHEMBL7404140 0.86 F2 (0.50) F2PRSS1PRSS2PRSS3
SCHEMBL7408234 0.84 EGLN1 (0.39) F2
SCHEMBL7408144 0.83 F2 (0.51) F2PRSS1PRSS2PRSS3
SCHEMBL7408227 0.80 F2 (0.46) F2PRSS1PRSS2PRSS3
SCHEMBL7361749 0.79 F2 (0.48) F2
SCHEMBL7405320 0.79 F2 (0.44) F2PRSS1PRSS2PRSS3
SCHEMBL7449943 0.79 F2 (0.53) F2PRSS1PRSS2PRSS3
SCHEMBL7409009 0.77 F2 (0.43) F2PRSS1PRSS2PRSS3

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
EP-1341784-A2 PROCESS FOR MAKING A THROMBIN INHIBITOR Merck & Co., Inc. (US) 2003-09-10 EP disclosed
US-20020103379-A1 Process for making a thrombin inhibitor MERCK SHARP & DOHME LTD. (GB) 2002-08-01 US disclosed
WO-2002057225-A2 THROMBIN INHIBITORS MERCK & CO., INC. (US) 2002-07-25 WO disclosed
WO-2002046160-A2 PROCESS FOR MAKING A THROMBIN INHIBITOR MERCK & CO., INC. (US) 2002-06-13 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-20020103379-A1 Process for making a thrombin inhibitor TFPI, TFPI2, F2 F2 3/4885PRSS1 175/4885PRSS2 100/4885

“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.