SCHEMBL6159219

SCHEMBL6159219

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

nearest known ligand 0.60

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ HLCS P50747 3/20 0.60
▸ TDP1 Q9NUW8 5/20 0.58
▸ FOLH1 Q04609 5/20 0.57
▸ MEN1 O00255 1/20 0.57
▸ ABL1 P00519 1/20 0.57
▸ LMNA P02545 1/20 0.57
▸ PKM P14618 1/20 0.57
▸ IDE P14735 1/20 0.57
▸ MAPK1 P28482 1/20 0.57
▸ KMT2A Q03164 1/20 0.57
▸ RIN1 Q13671 1/20 0.57
▸ L3MBTL1 Q9Y468 1/20 0.57
▸ CNR1 P21554 1/20 0.51
▸ NOD1 Q9Y239 1/20 0.49
▸ CAPN1 P07384 2/20 0.49
▸ CA12 O43570 2/20 0.48
▸ CA1 P00915 2/20 0.48
▸ CA2 P00918 2/20 0.48
▸ CA9 Q16790 2/20 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
SCHEMBL5817718 0.98 HLCS (0.63) HLCSTDP1FOLH1MEN1ABL1
SCHEMBL515856 0.97 HLCS (0.64) HLCSTDP1FOLH1MEN1ABL1
SCHEMBL2456107 0.97 HLCS (0.64) HLCSTDP1FOLH1MEN1ABL1
SCHEMBL5821183 0.97 HLCS (0.64) HLCSTDP1FOLH1MEN1ABL1
SCHEMBL30337427 0.97 HLCS (0.58) HLCSTDP1FOLH1MEN1ABL1
SCHEMBL30800274 0.96 TDP1 (0.61) HLCSTDP1FOLH1MEN1ABL1
SCHEMBL5804916 0.96 TDP1 (0.61) HLCSTDP1FOLH1MEN1ABL1
SCHEMBL31065870 0.92 HLCS (0.58) HLCSTDP1FOLH1MEN1ABL1
SCHEMBL15353872 0.88 TDP1 (0.64) HLCSTDP1FOLH1MEN1ABL1
SCHEMBL739034 0.88 TDP1 (0.63) HLCSTDP1FOLH1MEN1ABL1

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 35 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5747352-A Reagents and methods for the rapid and quantitative assay of pharmacological agents BECKMAN INSTRUMENTS, INC. (US) 1998-05-05 — — US claimed
EP-0710361-A1 REAGENTS AND METHODS FOR THE RAPID AND QUANTITATIVE ASSAY OF PHARMACOLOGICAL AGENTS BECKMAN INSTRUMENTS, INC. (US) 1996-05-08 — — EP claimed
WO-1995032428-A1 REAGENTS AND METHODS FOR THE RAPID AND QUANTITATIVE ASSAY OF PHARMACOLOGICAL AGENTS BECKMAN INSTRUMENTS, INC. (US) 1995-11-30 — — WO claimed
CN-114656791-B Polymer-silica hybrid PDOT and methods of use thereof 华盛顿大学 2024-02-09 — — CN disclosed
EP-0852005-B1 COMPETITIVE IMMUNOASSAY DEVICE BECKMAN COULTER INC (US) 2005-02-09 — — EP disclosed
US-20030129191-A1 Pretargeting methods and compounds NEORX CORPORATION (US) 2003-07-10 — — US disclosed
US-6416738-B1 ADMINISTERING TO A RECIPIENT A FIRST CONJUGATE COMPRISING A TARGETING MOIETY AND A MEMBER OF A LIGAND/ANTI-LIGAND BINDING PAIR, THEREAFTER ADMINISTERING TO THE RECIPIENT A CLEARING AGENT, ADMINISTERING SECOND CONJUGATE NEORX CORPORATION 2002-07-09 — — US disclosed
US-6075010-A Small molecular weight ligand-hexose containing clearing agents NEORX CORPORATION (US) 2000-06-13 — — US disclosed
EP-0315317-B2 Bidentate conjugate and method of use thereof BECKMAN INSTRUMENTS INC (US) 2000-05-10 — — EP disclosed
EP-0852005-A4 COMPETITIVE IMMUNOASSAY DEVICE SMITHKLINE DIAGNOSTICS INC (US) 1999-06-09 — — EP disclosed
EP-0743956-A4 PRETARGETING METHODS AND COMPOUNDS NEORX CORP (US) 1999-03-24 — — EP disclosed
WO-1990009393-A1 METHOD OF SEPARATING OLIGONUCLEOTIDES FROM A MIXTURE WORCESTER FOUNDATION FOR EXPERIMENTAL BIOLOGY (US) 1990-08-23 — — WO disclosed
EP-0165313-B1 NUCLEIC ACID HYBRIDIZATION ASSAY HRI RESEARCH, INC. (US) 1989-11-15 — — EP disclosed
EP-0315317-A2 Bidentate conjugate and method of use thereof BECKMAN INSTRUMENTS, INC. (US) 1989-05-10 — — EP disclosed
WO-1989003041-A2 TRIDENTATE CONJUGATE AND METHOD OF USE THEREOF BECKMAN INSTRUMENTS, INC. (US) 1989-04-06 — — WO disclosed
EP-0310361-A2 Tridentate conjugate and method of use thereof BECKMAN INSTRUMENTS, INC. (US) 1989-04-05 — — EP disclosed
US-4599303-A PSORALEN DERIVATIVES HRI ASSOCIATES, INC. (US) 1986-07-08 — — US disclosed
EP-0165313-A4 NUCLEIC ACID HYBRIDIZATION ASSAY. HRI RES INC (US) 1986-05-16 — — EP disclosed
EP-0165313-A1 NUCLEIC ACID HYBRIDIZATION ASSAY. HYDROCARBON RESEARCH INC (US) 1985-12-27 — — EP disclosed
WO-1985002628-A1 NUCLEIC ACID HYBRIDIZATION ASSAY HRI RESEARCH, INC. (US) 1985-06-20 — — 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 (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-20030129191-A1 Pretargeting methods and compounds BTD, HLCS, STRA6 HLCS 2/4885TDP1 3339/4885FOLH1 124/4885

“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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