SCHEMBL29679269

SCHEMBL29679269

CC(C)(C)OC(=O)CC[C@H](NC(=O)N[C@@H](CCCCNC(=O)[C@@H](N)Cc1ccc(C(C)(C)C)cc1)C(=O)OC(C)(C)C)C(=O)OC(C)(C)C

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ CA1 P00915 2/20 0.42
▸ CA2 P00918 2/20 0.42
▸ TGM2 P21980 1/20 0.42
▸ TDP1 Q9NUW8 4/20 0.41
▸ PAX8 Q06710 2/20 0.41
▸ POLB P06746 2/20 0.40
▸ ATM Q13315 1/20 0.39
▸ KDM4E B2RXH2 1/20 0.38
▸ GLA P06280 1/20 0.38
▸ GAA P10253 1/20 0.38
▸ MAPT P10636 1/20 0.38
▸ MEN1 O00255 2/20 0.38
▸ KMT2A Q03164 2/20 0.38
▸ REN P00797 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ HPGD P15428 1/20 0.38
▸ NPSR1 Q6W5P4 1/20 0.38
▸ FOLH1 Q04609 1/20 0.38

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
SCHEMBL29679161 0.93 TDP1 (0.42) CA1CA2TGM2TDP1PAX8
SCHEMBL31514305 0.92 PLG (0.43) CA1CA2TDP1PAX8POLB
SCHEMBL29679077 0.92 FNTA (0.42) CA1CA2TDP1PAX8POLB
SCHEMBL31514296 0.92 TDP1 (0.49) TDP1PAX8MAPTMEN1KMT2A
SCHEMBL19065174 0.92 TDP1 (0.49) TDP1PAX8MAPTMEN1KMT2A
SCHEMBL19065173 0.92 TDP1 (0.49) TDP1PAX8MAPTMEN1KMT2A
SCHEMBL29679276 0.91 FOLH1 (0.46) CA1CA2TDP1PAX8MAPT
SCHEMBL29678732 0.87 MTNR1A (0.41) CA1CA2TDP1POLBMEN1
SCHEMBL29678991 0.87 FOLH1 (0.48) CA1CA2TGM2TDP1PAX8
SCHEMBL29678852 0.87 FOLH1 (0.48) CA1CA2TGM2TDP1PAX8

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 CA1 772/4885CA2 923/4885TGM2 1807/4885

“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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