SCHEMBL688085

SCHEMBL688085

COCCOCCOCCOCC[O]

nearest known ligand 0.41

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CA2 P00918 1/20 0.41
CYP3A4 P08684 1/20 0.32
TSHR P16473 1/20 0.32

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
SCHEMBL2397059 1.00 CA2 (0.41) CA2CYP3A4TSHR
SCHEMBL28408357 1.00 CA2 (0.41) CA2CYP3A4TSHR
SCHEMBL5243057 1.00 CA2 (0.41) CA2CYP3A4TSHR
SCHEMBL687625 1.00 CA2 (0.41) CA2CYP3A4TSHR
SCHEMBL224425 1.00
SCHEMBL5240827 1.00 CA2 (0.41) CA2CYP3A4TSHR
Hydrochloric Acid SCHEMBL28135038 0.94 CA2 (0.39) CA2CYP3A4TSHR
SCHEMBL23647292 0.83 CA2 (0.44) CA2CYP3A4TSHR
SCHEMBL14920 0.83 CA2 (0.44) CA2CYP3A4TSHR
SCHEMBL4607864 0.83 CA2 (0.44) CA2CYP3A4TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101393128-A Application of fluorescent probe for detecting enzyme activity and screening passivating agent CHINESE ACAD INST CHEMISTRY (CN) 2009-03-25 CN claimed
CN-118176231-A Curable resin composition 纳美仕有限公司 2024-06-11 CN disclosed
CN-112839922-B Hydrophilic and in particular water-soluble DBOV derivatives 马克斯·普朗克索赔科学公司 2024-04-02 CN disclosed
EP-3921320-B1 IMIDAZO [2, 1-F] [1, 2, 4] TRIAZIN-4-AMINE DERIVATIVES AS TLR7 AGONIST BEIGENE LTD (KY) 2024-03-06 EP disclosed
EP-3921319-B1 IMIDAZO [2, 1-F] [1, 2, 4] TRIAZIN-4-AMINE DERIVATIVES AS TLR7 AGONIST BEIGENE LTD (KY) 2024-03-06 EP disclosed
US-20230167117-A1 IMIDAZO[2,1-F][1,2,4]TRIAZIN-4-AMINE DERIVATIVES AS TLR7 AGONIST BEONE MEDICINES I GMBH (CH) 2023-06-01 US disclosed
EP-4008720-A1 IMIDAZO[2,1-F][1,2,4]TRIAZIN-4-AMINE DERIVATIVE USED AS TLR8 AGONIST BeiGene, Ltd. (KY) 2022-06-08 EP disclosed
US-20220119394-A1 IMIDAZO[2,1-F][1,2,4]TRIAZIN-4-AMINE DERIVATIVES AS TLR7 AGONIST BEONE MEDICINES I GMBH (CH) 2022-04-21 US disclosed
WO-2021261429-A1 CURABLE RESIN COMPOSITION, CURED FILM, LAMINATE, METHOD FOR PRODUCING CURED FILM, SEMICONDUCTOR DEVICE, AND THERMOSETTING RESIN 富士フイルム株式会社 2021-12-30 WO disclosed
WO-2021132578-A1 CURABLE RESIN COMPOSITION, CURED FILM, LAYERED PRODUCT, METHOD FOR PRODUCING CURED FILM, AND SEMICONDUCTOR DEVICE 富士フイルム株式会社 2021-07-01 WO disclosed
EP-0689507-A1 INK RIBBONS CONTAINING COMPOUNDS ABSORBING IN THE IR REGION BASF AKTIENGESELLSCHAFT (DE) 1996-01-03 EP disclosed
EP-0666474-A1 Use of infrared absorbing and fluorescent compositions for flaw detection BASF AKTIENGESELLSCHAFT (DE) 1995-08-09 EP disclosed
EP-0656929-A1 USE OF COMPOUNDS WHICH ABSORB AND/OR FLUORESCE IN THE I/R RANGE AS MARKERS FOR LIQUIDS. BASF AG (DE) 1995-06-14 EP disclosed
EP-0645259-A1 Thermal transfer of infrared dye-stuffs BASF Aktiengesellschaft (DE) 1995-03-29 EP disclosed
EP-0632108-A1 Pigment preparations with anthraquinone derivatives as dispersing agents BASF Aktiengesellschaft (DE) 1995-01-04 EP disclosed
EP-0628607-A2 Naphthalocyanine BASF Aktiengesellschaft (DE) 1994-12-14 EP disclosed
WO-1994021471-A1 INK RIBBONS CONTAINING COMPOUNDS ABSORBING IN THE IR REGION BASF AKTIENGESELLSCHAFT (DE) 1994-09-29 WO disclosed
WO-1994002570-A1 USE OF COMPOUNDS WHICH ABSORB AND/OR FLUORESCE IN THE I/R RANGE AS MARKERS FOR LIQUIDS BASF AKTIENGESELLSCHAFT (DE) 1994-02-03 WO disclosed
US-5282894-A Use of a liquid containing IR dyes as printing ink BASF AKTIENGESELLSCHAFT (DE) 1994-02-01 US disclosed
EP-0553614-A1 Use of infrared dyes containing liquid as a printing ink BASF Aktiengesellschaft (DE) 1993-08-04 EP 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-20230167117-A1 IMIDAZO[2,1-F][1,2,4]TRIAZIN-4-AMINE DERIVATIVES AS TLR7 AGONIST TLR7, TLR1, TLR9 CA2 2199/4885CYP3A4 1328/4885TSHR 590/4885
US-20220119394-A1 IMIDAZO[2,1-F][1,2,4]TRIAZIN-4-AMINE DERIVATIVES AS TLR7 AGONIST TLR7, TLR1, TLR3 CA2 2967/4885CYP3A4 2042/4885TSHR 546/4885

“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.