SCHEMBL29679271

SCHEMBL29679271

CC(=O)NCCCC[C@H](N)C(=O)NCCCC[C@H](NC(=O)N[C@@H](CCC(=O)OC(C)(C)C)C(=O)OC(C)(C)C)C(=O)OC(C)(C)C

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FOLH1 Q04609 5/20 0.47
▸ TDP1 Q9NUW8 4/20 0.40
▸ DPP7 Q9UHL4 2/20 0.40
▸ ATM Q13315 2/20 0.39
▸ GNAI3 P08754 1/20 0.39
▸ GNAO1 P09471 1/20 0.39
▸ GNAI1 P63096 1/20 0.39
▸ NOD1 Q9Y239 1/20 0.39
▸ CA1 P00915 3/20 0.38
▸ CA2 P00918 3/20 0.38
▸ MEN1 O00255 2/20 0.38
▸ KMT2A Q03164 2/20 0.38
▸ POLB P06746 2/20 0.38
▸ NPSR1 Q6W5P4 2/20 0.38
▸ SIRT6 Q8N6T7 1/20 0.36
▸ SIRT1 Q96EB6 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ SIRT5 Q9NXA8 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ HPGD P15428 1/20 0.36

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
SCHEMBL29679547 0.92 TDP1 (0.40) FOLH1TDP1DPP7ATMGNAI3
SCHEMBL30337966 0.91 FOLH1 (0.55) FOLH1TDP1ATMMEN1KMT2A
SCHEMBL25963701 0.91 FOLH1 (0.55) FOLH1TDP1ATMMEN1KMT2A
SCHEMBL29679190 0.91 TDP1 (0.39) FOLH1TDP1DPP7ATMGNAI3
SCHEMBL14680406 0.87 TDP1 (0.39) FOLH1TDP1DPP7ATMGNAI3
SCHEMBL29679162 0.85 MMP1 (0.45) FOLH1TDP1CA1CA2MEN1
SCHEMBL4320228 0.85 TDP1 (0.41) FOLH1TDP1ATMMEN1KMT2A
SCHEMBL19065174 0.84 TDP1 (0.49) FOLH1TDP1MEN1KMT2ANPSR1
SCHEMBL19065173 0.84 TDP1 (0.49) FOLH1TDP1MEN1KMT2ANPSR1
SCHEMBL31514296 0.84 TDP1 (0.49) FOLH1TDP1MEN1KMT2ANPSR1

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 2775/4885DPP7 3179/4885

“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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