SCHEMBL7069321

SCHEMBL7069321

CS(=O)(=O)c1ccccc1-c1ccc(CC(=O)N(Cc2cccc(C(=N)N)c2)CC2CCCCC2)cc1

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
OXTR P30559 1/20 0.48
F10 P00742 15/20 0.47
OPRM1 P35372 1/20 0.44
OPRD1 P41143 1/20 0.44
PRSS1 P07477 8/20 0.42
F2 P00734 5/20 0.42
PRSS2 P07478 4/20 0.42
PRSS3 P35030 4/20 0.42
PLG P00747 1/20 0.42
PLAT P00750 1/20 0.42
F7 P08709 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
SCHEMBL7068493 0.93 F10 (0.52) F10PRSS1F2PRSS2PRSS3
SCHEMBL7072368 0.87 F10 (0.49) F10PRSS1F2PRSS2PRSS3
SCHEMBL7096297 0.87 F10 (0.49) OXTRF10PRSS1F2PRSS2
SCHEMBL7072142 0.87 F10 (0.54) F10PRSS1F2PRSS2PRSS3
SCHEMBL7070021 0.86 F10 (0.50) F10PRSS1F2PRSS2PRSS3
SCHEMBL7074725 0.86 F10 (0.53) F10PRSS1F2PRSS2PRSS3
SCHEMBL7072431 0.85 F10 (0.43) F10OPRM1OPRD1PRSS1F2
SCHEMBL7073401 0.84 F10 (0.54) F10PRSS1F2PRSS2PRSS3
SCHEMBL7067784 0.84 F10 (0.51) F10PRSS1F2PRSS2PRSS3
SCHEMBL7072362 0.83 LTB4R2 (0.55) 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 OXTR 1170/4885F10 17/4885OPRM1 1334/4885

“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.