SCHEMBL7513014

SCHEMBL7513014

Cc1cnc(NCC(F)(F)c2ccccn2)c(=O)n1CC(=O)NCCc1ccncc1

nearest known ligand 0.73

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
F2 P00734 20/20 0.73
PRSS1 P07477 4/20 0.69
PRSS2 P07478 3/20 0.69
PRSS3 P35030 3/20 0.69
F10 P00742 1/20 0.55
PLAT P00750 1/20 0.55

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
SCHEMBL7643080 0.95 F2 (0.75) F2PRSS1PRSS2PRSS3F10
SCHEMBL7401128 0.92 F2 (0.71) F2PRSS1PRSS2PRSS3F10
SCHEMBL7643508 0.88 F2 (0.84) F2PRSS1PRSS2PRSS3
SCHEMBL7639399 0.88 F2 (0.75) F2PRSS1PRSS2PRSS3F10
SCHEMBL7404951 0.88 F2 (0.70) F2PRSS1PRSS2PRSS3
SCHEMBL7447701 0.88 F2 (0.75) F2PRSS1PRSS2PRSS3F10
SCHEMBL6957150 0.83 F2 (0.75) F2PRSS1PRSS2PRSS3
SCHEMBL7159400 0.80 F2 (0.73) F2PRSS1PRSS2PRSS3
SCHEMBL6957416 0.79 F2 (0.70) F2PRSS1PRSS2PRSS3
SCHEMBL7155849 0.79 F2 (0.75) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6462050-B1 FOR TREATING OR PREVENTING VENOUS, CARDIOGENIC, AND ARTERIAL THROMBOSIS/EMBOLISM, ATHERSCLEROSIS, AND FOR LOWERING PROPENSITY OF DEVICES THAT COME INTO CONTACT WITH BLOOD TO CLOT BLOOD MERCK & CO., INC. 2002-10-08 US disclosed
US-20020035115-A1 Thrombin inhibitors MERCK SHARP & DOHME CORP. 2002-03-21 US disclosed
WO-2002009711-A1 THROMBIN INHIBITORS MERCK & CO., INC. (US) 2002-02-07 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-20020035115-A1 Thrombin inhibitors TFPI, PLAT, F2 F2 3/4885PRSS1 55/4885PRSS2 96/4885

“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.