SCHEMBL29679079

SCHEMBL29679079

NCC1CCC(C(=O)N[C@@H](Cc2ccc(C3CCC3)cc2)C(=O)NCCCC[C@H](NC(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)O)CC1

nearest known ligand 0.58

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ FOLH1 Q04609 10/20 0.58
▸ PLG P00747 10/20 0.55
▸ PRSS1 P07477 8/20 0.55
▸ PRSS2 P07478 8/20 0.55
▸ PRSS3 P35030 8/20 0.55
▸ PLAU P00749 2/20 0.55

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
SCHEMBL29679197 0.90 PLG (0.68) FOLH1PLGPRSS1PRSS2PRSS3
SCHEMBL29679159 0.90 FOLH1 (0.62) FOLH1PLGPRSS1PRSS2PRSS3
SCHEMBL29679138 0.90 FOLH1 (0.60) FOLH1PLGPRSS1PRSS2PRSS3
SCHEMBL29679118 0.90 FOLH1 (0.64) FOLH1PLGPRSS1PRSS2PRSS3
SCHEMBL25963776 0.90 FOLH1 (0.60) FOLH1PLGPRSS1PRSS2PRSS3
SCHEMBL29679031 0.88 PLG (0.60) FOLH1PLGPRSS1PRSS2PRSS3
Trifluoroacetic Acid SCHEMBL30309112 0.86 FOLH1 (0.57) FOLH1PLGPRSS1PRSS2PRSS3
SCHEMBL23553003 0.86 FOLH1 (0.76) FOLH1PLGPRSS1PRSS2PRSS3
SCHEMBL29679057 0.86 FOLH1 (0.76) FOLH1PLGPRSS1PRSS2PRSS3
SCHEMBL29679477 0.86 FOLH1 (0.76) FOLH1PLGPRSS1PRSS2PRSS3

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-20230072421-A1 TARGETED RADIOPHARMACEUTICALS FOR THE DIAGNOSIS AND TREATMENT OF PROSTATE CANCER BAYER AS (NO) 2023-03-09 — — US disclosed
EP-4003959-A1 TARGETED RADIOPHARMACEUTICALS FOR THE DIAGNOSIS AND TREATMENT OF PROSTATE CANCER Bayer AS (NO) 2022-06-01 — — EP 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-20230072421-A1 TARGETED RADIOPHARMACEUTICALS FOR THE DIAGNOSIS AND TREATMENT OF PROSTATE CANCER KLK3, AR, SHBG FOLH1 43/4885PLG 685/4885PRSS1 118/4885

“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.

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