SCHEMBL22044586

SCHEMBL22044586

CC(C)(C)OC(=O)NCCCC[C@H](NC(=O)CCCN1C(=O)C=CC1=O)C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AKT1 P31749 1/20 0.48
▸ MEN1 O00255 3/20 0.45
▸ KMT2A Q03164 3/20 0.45
▸ GAA P10253 1/20 0.45
▸ ACE P12821 2/20 0.45
▸ TDP1 Q9NUW8 5/20 0.42
▸ ATM Q13315 1/20 0.42
▸ FOLH1 Q04609 1/20 0.41
▸ HDAC3 O15379 1/20 0.41
▸ HDAC1 Q13547 1/20 0.41
▸ HDAC8 Q9BY41 1/20 0.41
▸ HDAC6 Q9UBN7 1/20 0.41
▸ NPSR1 Q6W5P4 3/20 0.41
▸ POLB P06746 1/20 0.41
▸ CA1 P00915 3/20 0.41
▸ CA2 P00918 3/20 0.41
▸ ALDH1A1 P00352 2/20 0.40
▸ TSHR P16473 1/20 0.40
▸ SIRT5 Q9NXA8 1/20 0.40
▸ MAPT P10636 2/20 0.39

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
SCHEMBL31721990 0.88 AKT1 (0.51) AKT1ACEHDAC3HDAC1HDAC8
SCHEMBL22045035 0.87 AKT1 (0.48) AKT1MEN1KMT2AGAAACE
SCHEMBL15096516 0.87 POLB (0.45) AKT1MEN1KMT2ATDP1ATM
SCHEMBL23113662 0.86 AKT1 (0.48) AKT1MEN1KMT2AGAAACE
SCHEMBL22389098 0.86 ALB (0.47) FOLH1
SCHEMBL440126 0.85 AKT1 (0.44) AKT1MEN1KMT2AGAAACE
SCHEMBL440125 0.85 AKT1 (0.44) AKT1MEN1KMT2AGAAACE
SCHEMBL12148796 0.84 AKT1 (0.51) AKT1MEN1KMT2AGAATDP1
SCHEMBL31235812 0.84 AKT1 (0.42) AKT1KMT2AACEFOLH1HDAC3
SCHEMBL29333170 0.84 AKT1 (0.55) AKT1ACEHDAC1ALDH1A1TSHR

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4642484-A1 TARGETED TREATMENT OF PROSTATE CANCERS AND OTHER TUMORS BY AN ANTIBODY-DRUG CONJUGATE Hangzhou Seehe Biotechnology Co., Ltd (CN) 2025-11-05 — — EP disclosed
WO-2024239281-A1 TARGETED TREATMENT OF PROSTATE CANCERS AND OTHER TUMORS BY AN ANTIBODY-DRUG CONJUGATE HANGZHOU SEEHE BIOTECHNOLOGY CO., LTD (CN) 2024-11-28 — — WO disclosed
US-11873281-B2 Conjugates of cell binding molecules with cytotoxic agents HANGZHOU DAC BIOTECH CO., LTD. (CN) 2024-01-16 — — US disclosed
US-20200276261-A1 A CONJUGATE OF A TUBULYSIN ANALOG WITH BRANCHED LINKERS HANGZHOU DAC BIOTECH CO., LTD. (CN) 2020-09-03 — — US disclosed
US-20200172480-A1 CONJUGATES OF CELL BINDING MOLECULES WITH CYTOTOXIC AGENTS HANGZHOU DAC BIOTECH CO., LTD. (CN) 2020-06-04 — — 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 (3 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-11873281-B2 Conjugates of cell binding molecules with cytotoxic agents CD4, CD2, CD47 AKT1 2227/4885MEN1 163/4885KMT2A 2615/4885
US-20200172480-A1 CONJUGATES OF CELL BINDING MOLECULES WITH CYTOTOXIC AGENTS CD4, CD2, CD47 AKT1 2227/4885MEN1 163/4885KMT2A 2615/4885
US-20200276261-A1 A CONJUGATE OF A TUBULYSIN ANALOG WITH BRANCHED LINKERS TEKT1, TEK, BTN3A1 AKT1 4614/4885MEN1 281/4885KMT2A 2842/4885

“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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