SCHEMBL29679077

SCHEMBL29679077

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

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ FNTA P49354 1/20 0.42
▸ FNTB P49356 1/20 0.42
▸ PGGT1B P53609 1/20 0.42
▸ FOLH1 Q04609 5/20 0.42
▸ CA1 P00915 2/20 0.42
▸ CA2 P00918 2/20 0.42
▸ CTSS P25774 1/20 0.41
▸ CTSK P43235 1/20 0.41
▸ PLK1 P53350 1/20 0.40
▸ TDP1 Q9NUW8 3/20 0.40
▸ PAX8 Q06710 1/20 0.40
▸ POLB P06746 1/20 0.40
▸ ATM Q13315 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
SCHEMBL14680632 0.94 FNTA (0.41) FNTAFNTBPGGT1BFOLH1CA1
SCHEMBL29679269 0.92 CA1 (0.42) FOLH1CA1CA2TDP1PAX8
SCHEMBL29679161 0.92 TDP1 (0.42) FNTAFNTBPGGT1BCA1CA2
SCHEMBL31514305 0.91 PLG (0.43) FNTAFNTBPGGT1BCA1CA2
SCHEMBL19065173 0.91 TDP1 (0.49) FOLH1TDP1PAX8
SCHEMBL19065174 0.91 TDP1 (0.49) FOLH1TDP1PAX8
SCHEMBL31514296 0.91 TDP1 (0.49) FOLH1TDP1PAX8
SCHEMBL29679276 0.90 FOLH1 (0.46) FOLH1CA1CA2CTSSCTSK
SCHEMBL29679237 0.90 CTSS (0.45) FOLH1CA1CA2CTSSCTSK
SCHEMBL29678883 0.89 TDP1 (0.39) FNTAFNTBPGGT1BCA1CA2

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 FNTA 2448/4885FNTB 2961/4885PGGT1B 957/4885

“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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