SCHEMBL7068680

SCHEMBL7068680

N=C(NO)c1cccc(CN(C(=O)Cc2ccc(-c3ccccc3S(N)(=O)=O)cc2)c2ccccc2)c1

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
LTB4R2 Q9NPC1 1/20 0.49
F10 P00742 8/20 0.48
F2 P00734 13/20 0.47
PRSS1 P07477 12/20 0.47
PRSS2 P07478 12/20 0.47
PRSS3 P35030 12/20 0.47
PLG P00747 2/20 0.46
PLAT P00750 2/20 0.46
F7 P08709 2/20 0.46

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
SCHEMBL7073613 0.90 F10 (0.59) LTB4R2F10F2PRSS1PRSS2
SCHEMBL7075440 0.89 F10 (0.52) F10F2PRSS1PRSS2PRSS3
SCHEMBL7070282 0.88 F10 (0.46) LTB4R2F10F2PRSS1PRSS2
SCHEMBL7073588 0.87 F10 (0.49) F10F2PRSS1PRSS2PRSS3
SCHEMBL7099089 0.87 F10 (0.50) F10F2PRSS1PRSS2PRSS3
SCHEMBL7068387 0.86 F2 (0.49) LTB4R2F10F2PRSS1PRSS2
SCHEMBL7076082 0.86 F10 (0.50) F10F2PRSS1PRSS2PRSS3
SCHEMBL7073651 0.86 F10 (0.48) F10F2PRSS1PRSS2PRSS3
SCHEMBL7069957 0.85 F2 (0.43) LTB4R2F10F2PRSS1PRSS2
SCHEMBL7074934 0.84 LTB4R2 (0.52) LTB4R2F10F2PRSS1PRSS2

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 LTB4R2 690/4885F10 17/4885F2 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.