SCHEMBL7075571

SCHEMBL7075571

COc1ccc(C(=S)NC(=N)c2cccc(CN(Cc3ccccc3)C(=O)Cc3ccc(-c4ccccc4S(N)(=O)=O)cc3)c2)cc1

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
F10 P00742 13/20 0.49
PRSS1 P07477 7/20 0.44
F2 P00734 6/20 0.44
PRSS2 P07478 6/20 0.44
PRSS3 P35030 6/20 0.44
PLG P00747 2/20 0.44
PLAT P00750 2/20 0.44
F7 P08709 2/20 0.44
SCN9A Q15858 2/20 0.43
MEN1 O00255 1/20 0.42
ALDH1A1 P00352 1/20 0.42
ALOX12 P18054 1/20 0.42
HTT P42858 1/20 0.42
KMT2A Q03164 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
GPR55 Q9Y2T6 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42

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
SCHEMBL7074088 0.95 F10 (0.45) F10PRSS1F2PRSS2PRSS3
SCHEMBL7072101 0.94 F10 (0.46) F10PRSS1F2PRSS2PRSS3
SCHEMBL7072626 0.93 F10 (0.44) F10PRSS1F2PRSS2PRSS3
SCHEMBL7072039 0.92 F10 (0.46) F10PRSS1F2PRSS2PRSS3
SCHEMBL7070528 0.92 SCN9A (0.47) F10PRSS1F2PRSS2PRSS3
SCHEMBL7072115 0.92 F10 (0.46) F10PRSS1F2PRSS2PRSS3
SCHEMBL7074957 0.91 F10 (0.45) F10PRSS1F2PRSS2PRSS3
SCHEMBL7083170 0.91 F10 (0.51) F10PRSS1F2PRSS2PRSS3
SCHEMBL7070281 0.90 F10 (0.43) F10PRSS1F2PRSS2PRSS3
SCHEMBL7072361 0.90 SCN9A (0.45) F10PRSS1F2PRSS2PRSS3

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-20030187037-A1 Acetamide derivatives and the use thereof as inhibitors of coagulation factors xa and viia MERCK-PATENT GMBH (DE) 2003-10-02 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-20030187037-A1 Acetamide derivatives and the use thereof as inhibitors of coagulation factors xa and viia F12, F11, PLAT F10 17/4885PRSS1 130/4885F2 7/4885

“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.