SCHEMBL24312910

SCHEMBL24312910

N=C(N)c1ccc2nc(-c3ccc4nc(-c5ccc(C(N)=O)cc5)[nH]c4c3)[nH]c2c1

nearest known ligand 0.82

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PLAU P00749 2/20 0.71
PRSS1 P07477 1/20 0.71
CHEK2 O96017 10/20 0.69
PKN1 Q16512 1/20 0.66
PKN2 Q16513 1/20 0.66
PLG P00747 1/20 0.65

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
SCHEMBL29557707 1.00 PLAU (0.71) PLAUPRSS1CHEK2PKN1PKN2
SCHEMBL12348362 0.92 PLAU (0.79) PLAUPRSS1PLG
SCHEMBL14519390 0.90 PLAU (0.86) PLAUPRSS1PLG
SCHEMBL5517426 0.89 PLAU (0.83) PLAUPRSS1PLG
SCHEMBL14355116 0.89 PLAU (0.83) PLAUPRSS1CHEK2PLG
SCHEMBL29367440 0.88 PLAU (0.73) PLAUPRSS1CHEK2PLG
Acetic Acid SCHEMBL20982621 0.88 PLAU (0.78) PLAUPRSS1CHEK2PLG
SCHEMBL24312880 0.88 PLAU (0.81) PLAUPRSS1CHEK2PLG
SCHEMBL20982670 0.87 CHEK2 (0.86) CHEK2PKN1PKN2
SCHEMBL14519369 0.86 PLAU (0.74) PLAUPRSS1CHEK2PLG

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-20220096441-A1 TREATMENT OF ACANTHAMOEBA OR BALAMUTHIA TROPHOZOITES AND/OR CYSTS GEORGIA STATE UNIVERSITY RESEARCH FOUNDATION, INC. (US) 2022-03-31 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-20220096441-A1 TREATMENT OF ACANTHAMOEBA OR BALAMUTHIA TROPHOZOITES AND/OR CYSTS PKD2, PKD1, MUC1 PLAU 959/4885PRSS1 2689/4885CHEK2 241/4885

“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.