SCHEMBL1115969

SCHEMBL1115969

CCCC(=O)NC(CCCNC(=N)N)C(=O)O

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ NOD1 Q9Y239 13/20 0.53
▸ GNPAT O15228 1/20 0.46
▸ SLC6A5 Q9Y345 2/20 0.45
▸ EPHX2 P34913 1/20 0.44
▸ C3AR1 Q16581 1/20 0.43
▸ NPY1R P25929 1/20 0.42
▸ NPY2R P49146 1/20 0.42
▸ NPY4R P50391 1/20 0.42
▸ NPY5R Q15761 1/20 0.42
▸ FNTA P49354 1/20 0.42
▸ FNTB P49356 1/20 0.42
▸ PGGT1B P53609 1/20 0.42

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
SCHEMBL1115964 1.00 NOD1 (0.53) NOD1GNPATSLC6A5EPHX2C3AR1
Hydrochloric Acid SCHEMBL3423146 0.99 NOD1 (0.52) NOD1GNPATSLC6A5EPHX2C3AR1
SCHEMBL29949573 0.93 NOD1 (0.58) NOD1GNPATSLC6A5EPHX2
Trifluoroacetic Acid SCHEMBL7445678 0.92 NPY4R (0.49) NOD1GNPATSLC6A5EPHX2C3AR1
SCHEMBL7135086 0.92 NOD1 (0.64) NOD1SLC6A5EPHX2
SCHEMBL11011526 0.92 NOD1 (0.64) NOD1SLC6A5EPHX2
SCHEMBL2343614 0.91 NOD1 (0.66) NOD1SLC6A5EPHX2
SCHEMBL359523 0.91 NOD1 (0.66) NOD1SLC6A5EPHX2
SCHEMBL2344383 0.91 NOD1 (0.66) NOD1SLC6A5EPHX2
SCHEMBL11102825 0.91 NOD1 (0.66) NOD1SLC6A5EPHX2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3272764-B1 METHOD FOR AFFINITY CHROMATOGRAPHY NOVARTIS AG (CH) 2024-02-07 — — EP claimed
EP-2513134-B1 WASH SOLUTION AND METHOD FOR AFFINITY CHROMATOGRAPHY NOVARTIS AG (CH) 2017-09-06 — — EP claimed
CN-102089319-B Protein reforming method AJINOMOTO KK 2013-11-13 — — CN claimed
EP-2046393-A2 CONTROLLED RELEASE OF PHENOLIC OPIOIDS Pharmacofore, Inc. (US) 2009-04-15 — — EP claimed
WO-2008101202-A1 N-17-ALKYLATED PRODRUGS OF OPIOIDS PHARMACOFORE, INC. (US) 2008-08-21 — — WO claimed
WO-2007140272-A2 CONTROLLED RELEASE OF PHENOLIC OPIOIDS PHARMACOFORE, INC. (US) 2007-12-06 — — WO claimed
CN-1680426-A Purification method which prevents denaturation of an antibody AJINOMOTO KK (JP) 2005-10-12 — — CN claimed
CN-112955458-B Method for producing refolded protein using flow microreactor and refolding device for protein 味之素株式会社 2024-11-29 — — CN disclosed
EP-3272764-B1 METHOD FOR AFFINITY CHROMATOGRAPHY NOVARTIS AG (CH) 2024-02-07 — — EP disclosed
WO-2023175064-A1 METHODS FOR PURIFYING BISPECIFIC ANTIBODIES ASTRAZENECA AB (SE) 2023-09-21 — — WO disclosed
CN-112955458-A Method for producing refolded protein using flow microreactor and apparatus for refolding protein 味之素株式会社 2021-06-11 — — CN disclosed
CN-107365388-B Method for preparing polymer protein 味之素株式会社 2021-05-14 — — CN disclosed
CN-105517568-B Method for preventing aggregation of viral components 由卫生福利和体育大臣代表的荷兰王国 2020-07-07 — — CN disclosed
CN-102089319-A Protein reforming method AJINOMOTO KK 2011-06-08 — — CN disclosed
US-20110077384-A1 PROTEIN REFOLDING METHOD AJINOMOTO CO., INC. (JP) 2011-03-31 — — US disclosed
EP-2281827-A1 PROTEIN REFORMING METHOD Ajinomoto Co., Inc. (JP) 2011-02-09 — — EP disclosed
CN-1680426-B Purification method which prevents denaturation of an antibody AJINOMOTO KK 2010-05-26 — — CN disclosed
EP-2175019-A2 Quasirandom structure and function guided synthesis methods Nuevolution A/S (DK) 2010-04-14 — — EP disclosed
US-20080193983-A1 Quasirandom Structure and Function Guided Synthesis Methods NUEVOLUTION A/S (DK) 2008-08-14 — — US disclosed
CN-1680426-A Purification method which prevents denaturation of an antibody AJINOMOTO KK (JP) 2005-10-12 — — CN 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-20080193983-A1 Quasirandom Structure and Function Guided Synthesis Methods PARN, POLN, NCL NOD1 210/4885GNPAT 2894/4885SLC6A5 2856/4885

“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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