SCHEMBL1726093

SCHEMBL1726093

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

nearest known ligand 0.73

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 6/20 0.73
▸ MEN1 O00255 1/20 0.73
▸ ABL1 P00519 1/20 0.73
▸ LMNA P02545 1/20 0.73
▸ PKM P14618 1/20 0.73
▸ IDE P14735 1/20 0.73
▸ MAPK1 P28482 1/20 0.73
▸ KMT2A Q03164 1/20 0.73
▸ RIN1 Q13671 1/20 0.73
▸ L3MBTL1 Q9Y468 1/20 0.73
▸ HLCS P50747 6/20 0.59
▸ CA12 O43570 7/20 0.53
▸ CA1 P00915 7/20 0.53
▸ CA2 P00918 7/20 0.53
▸ CA9 Q16790 7/20 0.53

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
SCHEMBL14572650 0.88 TDP1 (0.64) TDP1MEN1ABL1LMNAPKM
SCHEMBL13857683 0.88 TDP1 (0.71) TDP1MEN1ABL1LMNAPKM
SCHEMBL22692170 0.87 TDP1 (0.61) TDP1MEN1ABL1LMNAPKM
SCHEMBL13802847 0.87 TDP1 (0.63) TDP1MEN1ABL1LMNAPKM
SCHEMBL6036972 0.87 TDP1 (0.76) TDP1MEN1ABL1LMNAPKM
SCHEMBL15123570 0.87 TDP1 (0.76) TDP1MEN1ABL1LMNAPKM
Biotin SCHEMBL28397155 0.86 TDP1 (0.97) TDP1MEN1ABL1LMNAPKM
SCHEMBL13790965 0.86 TDP1 (0.65) TDP1MEN1ABL1LMNAPKM
SCHEMBL1726151 0.86 TDP1 (0.65) TDP1MEN1ABL1LMNAPKM
Biotin SCHEMBL23055065 0.85 TDP1 (1.00) 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 18 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7473535-B2 Chemical reagents and methods for detection and quantification of proteins in complex mixtures THE INSTITUTE FOR SYSTEMS BIOLOGY (US) 2009-01-06 — — US claimed
US-20220354974-A1 REAGENTS AND METHODS FOR LABELING MOLECULES WITH ASTATINE ISOTOPES IN HIGHER OXIDATION STATES UNIVERSITY OF WASHINGTON (US) 2022-11-10 — — US disclosed
WO-2012034613-A3 REFRIGERATOR RED BULL GMBH (AT) 2012-05-10 — — WO disclosed
EP-1329513-B1 Rapid quantitative analysis of proteins or protein function in complex mixtures UNIV WASHINGTON (US) 2011-12-07 — — EP disclosed
US-7544518-B2 Rapid quantitative analysis of proteins or protein function in complex mixtures UNIVERSITY OF WASHINGTON (US) 2009-06-09 — — US disclosed
US-20090111195-A1 CHEMICAL REAGENTS AND METHODS FOR DETECTION AND QUANTIFICATION OF PROTEINS IN COMPLEX MIXTURES THE INSTITUTE FOR SYSTEMS BIOLOGY (US) 2009-04-30 — — US disclosed
US-7473535-B2 Chemical reagents and methods for detection and quantification of proteins in complex mixtures THE INSTITUTE FOR SYSTEMS BIOLOGY (US) 2009-01-06 — — US disclosed
US-20050233399-A1 Rapid quantitative analysis of proteins or protein function in complex mixtures UNIVERSITY OF WASHINGTON 2005-10-20 — — US disclosed
US-6852544-B2 Rapid quantitative analysis of proteins or protein function in complex mixtures UNIVERSITY OF WASHINGTON (US) 2005-02-08 — — US disclosed
US-20040038319-A1 Chemical reagents and methods for detection and quantification of proteins in complex mixtures INSTITUTE FOR SYSTEMS BIOLOGY, THE 2004-02-26 — — US disclosed
US-6670194-B1 Mass spectrometry; screening for changes in the expression of enzymatic activity of specific proteins induced by absence, deficiency or excess of a given protein UNIVERSITY OF WASHINGTON 2003-12-30 — — US disclosed
EP-1105517-B1 RAPID QUANTITATIVE ANALYSIS OF PROTEINS OR PROTEIN FUNCTION IN COMPLEX MIXTURES UNIV WASHINGTON (US) 2003-10-29 — — EP disclosed
EP-1329513-A1 Rapid quantitative analysis of proteins or protein function in complex mixtures UNIVERSITY OF WASHINGTON (US) 2003-07-23 — — EP disclosed
US-20030087322-A9 Rapid quantitative analysis of proteins or protein function in complex mixtures UNIVERSITY OF WASHINGTON 2003-05-08 — — US disclosed
US-20020076739-A1 Rapid quantitative analysis of proteins or protein function in complex mixtures UNIVERSITY OF WASHINGTON 2002-06-20 — — US disclosed
EP-1105517-A4 RAPID QUANTITATIVE ANALYSIS OF PROTEINS OR PROTEIN FUNCTION IN COMPLEX MIXTURES UNIV WASHINGTON (US) 2001-09-19 — — EP disclosed
EP-1105517-A1 RAPID QUANTITATIVE ANALYSIS OF PROTEINS OR PROTEIN FUNCTION IN COMPLEX MIXTURES UNIVERSITY OF WASHINGTON (US) 2001-06-13 — — EP disclosed
WO-2000011208-A1 RAPID QUANTITATIVE ANALYSIS OF PROTEINS OR PROTEIN FUNCTION IN COMPLEX MIXTURES UNIVERSITY OF WASHINGTON (US) 2000-03-02 — — WO 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 (5 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-20020076739-A1 Rapid quantitative analysis of proteins or protein function in complex mixtures PRTN3, RPS27A, PA2G4 TDP1 4040/4885MEN1 2976/4885ABL1 3933/4885
US-20220354974-A1 REAGENTS AND METHODS FOR LABELING MOLECULES WITH ASTATINE ISOTOPES IN HIGHER OXIDATION STATES AADAT, CKMT1A; CKMT1B, MB TDP1 3107/4885MEN1 4288/4885ABL1 924/4885
US-20040038319-A1 Chemical reagents and methods for detection and quantification of proteins in complex mixtures STUB1, INHA, IAPP TDP1 3110/4885MEN1 953/4885ABL1 107/4885
US-20030087322-A9 Rapid quantitative analysis of proteins or protein function in complex mixtures PRTN3, RPS27A, PA2G4 TDP1 4040/4885MEN1 2976/4885ABL1 3933/4885
US-20090111195-A1 CHEMICAL REAGENTS AND METHODS FOR DETECTION AND QUANTIFICATION OF PROTEINS IN COMPLEX MIXTURES STUB1, INHA, IAPP TDP1 3110/4885MEN1 953/4885ABL1 107/4885

“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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