SCHEMBL29679276

SCHEMBL29679276

CC(C)(C)OC(=O)CC[C@H](NC(=O)N[C@@H](CCCCNC(=O)[C@@H](N)Cc1ccc(-c2ccccc2)cc1)C(=O)OC(C)(C)C)C(=O)OC(C)(C)C

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ FOLH1 Q04609 2/20 0.46
▸ TDP1 Q9NUW8 2/20 0.45
▸ PAX8 Q06710 1/20 0.45
▸ CTSS P25774 1/20 0.43
▸ CTSK P43235 1/20 0.43
▸ MEN1 O00255 2/20 0.42
▸ KMT2A Q03164 2/20 0.42
▸ ALDH1A1 P00352 1/20 0.42
▸ HPGD P15428 1/20 0.42
▸ MAPT P10636 2/20 0.41
▸ NPSR1 Q6W5P4 2/20 0.41
▸ CA1 P00915 1/20 0.41
▸ CA2 P00918 1/20 0.41
▸ MMP1 P03956 1/20 0.41
▸ MMP3 P08254 1/20 0.41
▸ MMP9 P14780 1/20 0.41
▸ CPB1 P15086 1/20 0.41
▸ CPB2 Q96IY4 1/20 0.41

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
SCHEMBL19065174 0.95 TDP1 (0.49) FOLH1TDP1PAX8MEN1KMT2A
SCHEMBL19065173 0.95 TDP1 (0.49) FOLH1TDP1PAX8MEN1KMT2A
SCHEMBL31514296 0.95 TDP1 (0.49) FOLH1TDP1PAX8MEN1KMT2A
SCHEMBL29679161 0.91 TDP1 (0.42) TDP1PAX8MAPTNPSR1CA1
SCHEMBL29679269 0.91 CA1 (0.42) FOLH1TDP1PAX8MEN1KMT2A
SCHEMBL31514305 0.90 PLG (0.43) TDP1PAX8MEN1KMT2AALDH1A1
SCHEMBL29679077 0.90 FNTA (0.42) FOLH1TDP1PAX8CTSSCTSK
SCHEMBL19079056 0.90 TDP1 (0.44) FOLH1TDP1PAX8MEN1KMT2A
SCHEMBL29678991 0.89 FOLH1 (0.48) FOLH1TDP1PAX8CTSSCTSK
SCHEMBL29678852 0.89 FOLH1 (0.48) FOLH1TDP1PAX8CTSSCTSK

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 FOLH1 43/4885TDP1 2775/4885PAX8 1042/4885

“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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