SCHEMBL23066879

SCHEMBL23066879

NC(=O)C(N)CCCC(N)C(=O)CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@@H]21

nearest known ligand 0.62

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 6/20 0.62
▸ MEN1 O00255 1/20 0.61
▸ ABL1 P00519 1/20 0.61
▸ LMNA P02545 1/20 0.61
▸ PKM P14618 1/20 0.61
▸ IDE P14735 1/20 0.61
▸ MAPK1 P28482 1/20 0.61
▸ KMT2A Q03164 1/20 0.61
▸ RIN1 Q13671 1/20 0.61
▸ L3MBTL1 Q9Y468 1/20 0.61
▸ HLCS P50747 6/20 0.54
▸ CA12 O43570 7/20 0.48
▸ CA1 P00915 7/20 0.48
▸ CA2 P00918 7/20 0.48
▸ CA9 Q16790 7/20 0.48

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
SCHEMBL15053200 1.00 TDP1 (0.62) TDP1MEN1ABL1LMNAPKM
SCHEMBL912652 0.91 TDP1 (0.74) TDP1MEN1ABL1LMNAPKM
SCHEMBL15647842 0.90 TDP1 (0.77) TDP1MEN1ABL1LMNAPKM
SCHEMBL2536441 0.89 TDP1 (0.62) TDP1MEN1ABL1LMNAPKM
Hydrochloric Acid SCHEMBL3417755 0.88 TDP1 (0.61) TDP1MEN1ABL1LMNAPKM
SCHEMBL6040739 0.86 TDP1 (0.67) TDP1MEN1ABL1LMNAPKM
SCHEMBL20417372 0.85 TDP1 (0.85) TDP1MEN1ABL1LMNAPKM
SCHEMBL12372458 0.85 TDP1 (0.85) TDP1MEN1ABL1LMNAPKM
Biotin SCHEMBL28084581 0.85 TDP1 (0.69) TDP1MEN1ABL1LMNAPKM
SCHEMBL23745168 0.85 TDP1 (0.85) TDP1MEN1ABL1LMNAPKM

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-11376307-B2 Compositions and methods of treating cancer with glycomimetic peptides SUSAVION BIOSCIENCES, INC. (US) 2022-07-05 — — US disclosed
US-20210069285-A1 COMPOSITIONS AND METHODS OF TREATING CANCER WITH GLYCOMIMETIC PEPTIDES WILD BOAR BIOSCIENCES, LLC 2021-03-11 — — 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 (2 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-20210069285-A1 COMPOSITIONS AND METHODS OF TREATING CANCER WITH GLYCOMIMETIC PEPTIDES NGLY1, LNPEP, CD47 TDP1 2449/4885MEN1 640/4885ABL1 482/4885
US-11376307-B2 Compositions and methods of treating cancer with glycomimetic peptides NGLY1, LNPEP, CD47 TDP1 2449/4885MEN1 640/4885ABL1 482/4885

“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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