SCHEMBL6095333

SCHEMBL6095333

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nearest known ligand 0.38

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 2/20 0.38
KEAP1 Q14145 1/20 0.38
NFE2L2 Q16236 1/20 0.38
CA2 P00918 1/20 0.37
TSHR P16473 1/20 0.33
TDP1 Q9NUW8 1/20 0.33

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
SCHEMBL1425274 1.00 HCAR2 (0.38) HCAR2KEAP1NFE2L2CA2TSHR
Ammonia Solution, Strong SCHEMBL29112117 0.92 KEAP1 (0.33) HCAR2KEAP1NFE2L2CA2
SCHEMBL1425276 0.89 HCAR2 (0.48) HCAR2KEAP1NFE2L2CA2TSHR
SCHEMBL8948865 0.89 HCAR2 (0.48) HCAR2KEAP1NFE2L2CA2TSHR
SCHEMBL1425277 0.89 HCAR2 (0.48) HCAR2KEAP1NFE2L2CA2TSHR
SCHEMBL28579726 0.87 HCAR2 (0.46) HCAR2KEAP1NFE2L2TSHRTDP1
SCHEMBL28733317 0.84 TSHR (0.33) CA2TSHRTDP1
SCHEMBL8975780 0.77
SCHEMBL28258115 0.75 TSHR (0.36) CA2TSHR
SCHEMBL27660393 0.75 TSHR (0.36) CA2TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108101883-B It is a kind of to be used to prevent drug of diabetic retinopathy and preparation method thereof 佳木斯大学附属第医院 2018-11-13 CN disclosed
US-7148350-B2 Compounds in the form of homodimeric or heterodimeric pro-drugs; process for obtaining these pro-drugs and their acceptable pharmaceutical salts and use of compounds in the treatment of phosphodiesterases-mediated diseases or dysfunction CRISTALIA PROD.QUI.FARM. LTDA (BR) 2006-12-12 US disclosed
EP-1315729-A4 COMPOUNDS IN THE FORM OF HOMODIMERIC, HETERODIMERIC AND/OR HOMO AND HETEROMULTIMERIC PRO-DRUGS; PROCESS FOR OBTAINING THESE PRO-DRUGS AND THEIR ACCEPTABLE PHARMACEUTICAL SALTS AND USE OF COMPOUNDS IN THE TREATMENT OF PHOSPHODIESTERASIS-MEDIATED DISEASES OR DYSFUNCTION CRISTALIA PRODUTOS QUIMICOS E (BR) 2004-07-07 EP disclosed
US-20040106629-A1 Compouds in the form of homodimeric, heterodimeric and/or homo and heteromultimeric pro-drugs; process for obtaining these pro-drugs and their acceptable pharmaceutical salts and use of compounds in the treatment of phosphodiesterasis-mediated deseases or dysfunction PACHECO, OGARI (BR) 2004-06-03 US disclosed
EP-1315729-A1 COMPOUNDS IN THE FORM OF HOMODIMERIC, HETERODIMERIC AND/OR HOMO AND HETEROMULTIMERIC PRO-DRUGS; PROCESS FOR OBTAINING THESE PRO-DRUGS AND THEIR ACCEPTABLE PHARMACEUTICAL SALTS AND USE OF COMPOUNDS IN THE TREATMENT OF PHOSPHODIESTERASIS-MEDIATED DISEASES OR DYSFUNCTION Cristalia Produtos Quimicos e Farmaceuticos Ltda (BR) 2003-06-04 EP disclosed
WO-2002012241-A1 COMPOUNDS IN THE FORM OF HOMODIMERIC, HETERODIMERIC AND/OR HOMO AND HETEROMULTIMERIC PRO-DRUGS; PROCESS FOR OBTAINING THESE PRO-DRUGS AND THEIR ACCEPTABLE PHARMACEUTICAL SALTS AND USE OF COMPOUNDS IN THE TREATMENT OF PHOSPHODIESTERASIS-MEDIATED DISEASES OR DYSFUNCTION Cristália Produtos Químicos e Farmacêuticos Ltda. (BR) 2002-02-14 WO disclosed
US-5488146-A SULFONATING MALEIC ANHYDRIDE WITH SULFUR TRIOXIDE; ADDING GLYCOLIC ACID; SALT FORMATION WITH ALKALINE EARTH OR ALKALI METAL HYDROXIDE; PRECIPITATING; ION EXCHANGING WITH SODIUM SALT LEVER BROTHERS COMPANY, DIVISION OF CONOPCO, INC. (US) 1996-01-30 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 (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-20040106629-A1 Compouds in the form of homodimeric, heterodimeric and/or homo and heteromultimeric pro-drugs; process for obtaining these pro-drugs and their acceptable pharmaceutical salts and use of compounds in the treatment of phosphodiesterasis-mediated deseases or dysfunction PEPD, PREP, PAPSS1 HCAR2 916/4885KEAP1 4599/4885NFE2L2 4139/4885

“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.