SCHEMBL14599541

SCHEMBL14599541

N=C(N)c1cccc(OCCC(O)COc2cccc(C(=N)N)c2)c1

nearest known ligand 0.68

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PRSS1 P07477 9/20 0.68
F2 P00734 7/20 0.62
PLG P00747 1/20 0.62
PRSS2 P07478 1/20 0.62
C1S P09871 1/20 0.62
PRSS3 P35030 1/20 0.62
F10 P00742 2/20 0.52

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
SCHEMBL7388981 0.85 PRSS1 (0.70) PRSS1F2PLGPRSS2C1S
SCHEMBL7381578 0.84 F2 (0.58) PRSS1F2PLGPRSS2C1S
SCHEMBL1820723 0.82 PRSS1 (0.66) PRSS1F2PLGPRSS2PRSS3
SCHEMBL7387777 0.81 PRSS1 (0.63) PRSS1F2PLGPRSS2C1S
SCHEMBL7386374 0.81 PRSS1 (0.56) PRSS1F2PLGPRSS2C1S
SCHEMBL7389290 0.81 PRSS1 (0.56) PRSS1F2PLGPRSS2C1S
SCHEMBL12989513 0.80 PRSS1 (1.00) PRSS1F2PLGPRSS2C1S
SCHEMBL14599537 0.80 PRSS1 (1.00) PRSS1F2PLGPRSS2C1S
SCHEMBL14599539 0.80 PRSS1 (1.00) PRSS1F2PLGPRSS2C1S
SCHEMBL7870926 0.79 TSHR (0.51)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070021483-A1 Amidine derivatives for treating amyloidosis NEUROCHEM (INTERNATIONAL) LIMITED (CH) 2007-01-25 US disclosed
US-20070021483-A1 Amidine derivatives for treating amyloidosis NEUROCHEM (INTERNATIONAL) LIMITED (CH) 2007-01-25 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-20070021483-A1 Amidine derivatives for treating amyloidosis APP, IAPP, GRN PRSS1 2062/4885F2 3712/4885PLG 2380/4885

“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.