SCHEMBL7098563

SCHEMBL7098563

CC(C)CN(Cc1cccc(C(=N)N)c1)C(=O)Nc1ccc(-c2ccccc2S(C)(=O)=O)cc1

nearest known ligand 0.53

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
F10 P00742 18/20 0.53
F2 P00734 5/20 0.52
PRSS1 P07477 6/20 0.51
PRSS2 P07478 2/20 0.51
PRSS3 P35030 2/20 0.51
KCNH2 Q12809 1/20 0.48

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
SCHEMBL7094631 0.94 F10 (0.61) F10F2PRSS1PRSS2PRSS3
SCHEMBL27589168 0.91 F10 (0.45) F10F2PRSS1PRSS2PRSS3
SCHEMBL6747940 0.91 F10 (0.51) F10F2PRSS1PRSS2PRSS3
SCHEMBL7093540 0.91 F10 (0.55) F10F2PRSS1PRSS2PRSS3
SCHEMBL7098175 0.90 F10 (0.54) F10F2PRSS1PRSS2PRSS3
SCHEMBL7094617 0.89 F10 (0.53) F10F2PRSS1PRSS2PRSS3
SCHEMBL7095379 0.88 F10 (0.54) F10F2PRSS1PRSS2PRSS3
SCHEMBL7099650 0.87 F10 (0.51) F10F2PRSS1PRSS2PRSS3
SCHEMBL7097187 0.86 F10 (0.56) F10F2PRSS1PRSS2PRSS3
SCHEMBL7094493 0.86 F10 (0.51) F10F2PRSS1PRSS2PRSS3

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-20030171579-A1 Urethane derivatives MERCK PATENT GMBH (DE) 2003-09-11 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-20030171579-A1 Urethane derivatives UTS2R, PLAUR, IL1A F10 42/4885F2 9/4885PRSS1 371/4885

“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.