SCHEMBL7144475

SCHEMBL7144475

CCOc1cc(OCC)c(F)c(C(Nc2ccc(C#N)cc2)C(=O)OC(C)C)c1

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
F10 P00742 7/20 0.42
F7 P08709 14/20 0.41
PRSS1 P07477 6/20 0.37
PRSS2 P07478 6/20 0.37
PRSS3 P35030 6/20 0.37
F3 P13726 1/20 0.37
F2 P00734 5/20 0.37
MMP2 P08253 1/20 0.36
MMP3 P08254 1/20 0.36
IDO1 P14902 1/20 0.36

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
SCHEMBL7149887 0.92 F10 (0.43) F10F7PRSS1PRSS2PRSS3
SCHEMBL5882284 0.89 F10 (0.52) F10F7PRSS1PRSS2PRSS3
SCHEMBL7147021 0.87 F10 (0.41) F10F7PRSS1PRSS2PRSS3
SCHEMBL7149864 0.82 F10 (0.49) F10F7PRSS1PRSS2PRSS3
SCHEMBL6876129 0.82 F10 (0.39) F10F7PRSS1PRSS2PRSS3
SCHEMBL13162156 0.82 CA12 (0.38) F10F7
SCHEMBL6872185 0.81 F10 (0.42) F10F7PRSS1PRSS2PRSS3
SCHEMBL7147108 0.81 PDE10A (0.35) IDO1
SCHEMBL7147090 0.80 F10 (0.53) F10F7PRSS1PRSS2PRSS3
SCHEMBL6874415 0.79 F10 (0.52) F10F7PRSS1PRSS2PRSS3

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6548694-B2 Anticoagulants HOFFMAN-LA ROCHE INC. 2003-04-15 US disclosed
EP-1289939-A1 PHENYLGLYCINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2003-03-12 EP disclosed
US-20020004608-A1 N-(4-carbamimidoyl-phenyl)-glycine derivatives F.HOFFMANN-LA ROCHE AG (CH) 2002-01-10 US disclosed
WO-2001090051-A1 PHENYLGLYCINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2001-11-29 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-20020004608-A1 N-(4-carbamimidoyl-phenyl)-glycine derivatives GLS, SLC6A5, GLRA1 F10 546/4885F7 422/4885PRSS1 506/4885

“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.