SCHEMBL24374933

SCHEMBL24374933

O=C(O)CCCCCCC(=O)NC[C@H]1CC[C@H](C(=O)N[C@@H](Cc2ccc3ccccc3c2)C(=O)NCCCC[C@H](NC(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)O)CC1

nearest known ligand 0.81

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ FOLH1 Q04609 19/20 0.81
▸ PLG P00747 1/20 0.52
▸ PRSS1 P07477 1/20 0.52
▸ PRSS2 P07478 1/20 0.52
▸ PRSS3 P35030 1/20 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
SCHEMBL31635857 0.99 FOLH1 (0.82) FOLH1PLGPRSS1PRSS2PRSS3
SCHEMBL27304711 0.96 FOLH1 (0.77) FOLH1PLGPRSS1PRSS2PRSS3
SCHEMBL21310479 0.94 FOLH1 (0.80) FOLH1PLGPRSS1PRSS2PRSS3
SCHEMBL22883225 0.94 FOLH1 (0.82) FOLH1PLGPRSS1PRSS2PRSS3
SCHEMBL21310703 0.94 FOLH1 (0.82) FOLH1PLGPRSS1PRSS2PRSS3
SCHEMBL27306091 0.93 FOLH1 (0.74) FOLH1PLGPRSS1PRSS2PRSS3
SCHEMBL27306322 0.93 FOLH1 (0.74) FOLH1PLGPRSS1PRSS2PRSS3
SCHEMBL17706000 0.93 FOLH1 (0.81) FOLH1PLGPRSS1PRSS2PRSS3
SCHEMBL23453197 0.93 FOLH1 (0.73) FOLH1PLGPRSS1PRSS2PRSS3
SCHEMBL27304566 0.93 FOLH1 (0.73) FOLH1

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-20220125957-A1 METHODS OF TREATING CANCER SATHEKGE MIKE (ZA) 2022-04-28 — — 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-20220125957-A1 METHODS OF TREATING CANCER PAICS, FOLH1, INHA FOLH1 2/4885PLG 810/4885PRSS1 3798/4885

“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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