SCHEMBL30451863

SCHEMBL30451863

CC(C)(C)OC[C@H](CCCC(=O)NC(=O)[C@H](Cc1cccc(I)c1)NC(=O)C1CCC(CNC(=O)OC(C)(C)C)CC1)NC(=O)N[C@@H](CCC(=O)OC(C)(C)C)C(=O)OC(C)(C)C

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 3/20 0.42
▸ ATM Q13315 2/20 0.42
▸ MEN1 O00255 2/20 0.41
▸ FOLH1 Q04609 5/20 0.36
▸ REN P00797 1/20 0.33
▸ PLG P00747 4/20 0.33
▸ PRSS1 P07477 4/20 0.33
▸ PRSS2 P07478 4/20 0.33
▸ PRSS3 P35030 4/20 0.33
▸ NPY5R Q15761 1/20 0.32
▸ SCN9A Q15858 1/20 0.32

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
SCHEMBL30309130 0.86 FOLH1 (0.47) KMT2AATMMEN1FOLH1PLG
SCHEMBL25963767 0.83 FOLH1 (0.45) KMT2AATMMEN1FOLH1PLG
SCHEMBL30309090 0.78 PLG (0.49) KMT2AATMMEN1FOLH1PLG
SCHEMBL30309109 0.76 FOLH1 (0.43) KMT2AATMMEN1FOLH1PLG
SCHEMBL25963760 0.76 PLG (0.47) KMT2AATMMEN1FOLH1PLG
SCHEMBL25964575 0.75 KMT2A (0.68) KMT2AATMMEN1
SCHEMBL30309096 0.75 KMT2A (0.68) KMT2AATMMEN1
SCHEMBL30309110 0.72 FOLH1 (0.42) FOLH1
SCHEMBL29678851 0.71 PLG (0.54) PLGPRSS1PRSS2PRSS3
SCHEMBL29678999 0.71 FOLH1 (0.44) KMT2AATMMEN1FOLH1PLG

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-20230201383-A1 PSMA TARGETING UREA-BASED LIGANDS FOR PROSTATE CANCER RADIOTHERAPY AND IMAGING RIGSHOSPITALET (DK) 2023-06-29 — — 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-20230201383-A1 PSMA TARGETING UREA-BASED LIGANDS FOR PROSTATE CANCER RADIOTHERAPY AND IMAGING KLK3, FOLH1, PSMA7 KMT2A 2730/4885ATM 114/4885MEN1 865/4885

“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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