SCHEMBL22228930

SCHEMBL22228930

CC(C)(C)OC(=O)[C@H](CCC(=O)NCCc1ccc(I)cc1)NC(=O)N[C@@H](CCC(=O)O)C(=O)O

nearest known ligand 0.52

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ FOLH1 Q04609 17/20 0.52
▸ ALB P02768 2/20 0.50
▸ NAALAD2 Q9Y3Q0 1/20 0.43

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
SCHEMBL22228931 1.00 FOLH1 (0.52) FOLH1ALBNAALAD2
SCHEMBL30892645 0.89 ALB (0.43) FOLH1ALB
SCHEMBL18770762 0.89 FOLH1 (0.63) FOLH1ALBNAALAD2
SCHEMBL22228923 0.84 FOLH1 (0.42) FOLH1NAALAD2
SCHEMBL22247625 0.84 FOLH1 (0.62) FOLH1ALB
SCHEMBL22466369 0.82 FOLH1 (0.79) FOLH1
SCHEMBL22466370 0.82 FOLH1 (0.79) FOLH1
SCHEMBL13559320 0.81 FOLH1 (0.72) FOLH1NAALAD2
SCHEMBL19743102 0.81 FOLH1 (0.46) FOLH1ALB
SCHEMBL18782273 0.80 FOLH1 (0.54) FOLH1NAALAD2

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-20240140971-A1 PSMA TARGETED RADIOHALOGENATED UREAS FOR CANCER RADIOTHERAPY THE JOHNS HOPKINS UNIVERSTY 2024-05-02 — — US disclosed
US-20200231614-A1 PSMA TARGETED RADIOHALOGENATED UREAS FOR CANCER RADIOTHERAPY THE JOHNS HOPKINS UNIVERSITY 2020-07-23 — — 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 (2 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-20200231614-A1 PSMA TARGETED RADIOHALOGENATED UREAS FOR CANCER RADIOTHERAPY PSMA7, PSMA6, PSMA1 FOLH1 28/4885ALB 3187/4885NAALAD2 547/4885
US-20240140971-A1 PSMA TARGETED RADIOHALOGENATED UREAS FOR CANCER RADIOTHERAPY PSMA3, PSMA6, PSMA7 FOLH1 10/4885ALB 3167/4885NAALAD2 209/4885

“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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