SCHEMBL1566049

SCHEMBL1566049

[CH2]COc1ccc(C=O)c(OC)c1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.69
MAOB P27338 2/20 0.51
L3MBTL1 Q9Y468 1/20 0.50
CYP1A2 P05177 7/20 0.49
CYP1A1 P04798 6/20 0.49
CYP1B1 Q16678 6/20 0.49
TUBB1 Q9H4B7 1/20 0.48
KDM4E B2RXH2 1/20 0.47
TSHR P16473 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
TRIM24 O15164 1/20 0.45
TYR P14679 1/20 0.45
TRIM33 Q9UPN9 1/20 0.45
MEN1 O00255 1/20 0.44
MAPT P10636 1/20 0.44
KMT2A Q03164 1/20 0.44
NFE2L2 Q16236 2/20 0.44
ERN1 O75460 1/20 0.43
LMNA P02545 1/20 0.42
CYP2C9 P11712 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
SCHEMBL22322037 0.87 TUBB1 (0.62) ALDH1A1MAOBCYP1A2CYP1A1CYP1B1
SCHEMBL5654410 0.86 ALDH1A1 (0.63) ALDH1A1MAOBL3MBTL1CYP1A2CYP1A1
SCHEMBL22322045 0.85 ALDH1A1 (0.49) ALDH1A1MAOBL3MBTL1CYP1A2TUBB1
SCHEMBL702232 0.85 ALDH1A1 (0.71) ALDH1A1MAOBL3MBTL1CYP1A2CYP1A1
SCHEMBL14539352 0.83 ALDH1A1 (0.69) ALDH1A1MAOBL3MBTL1CYP1A2CYP1A1
SCHEMBL3905573 0.83 ALDH1A1 (0.69) ALDH1A1MAOBL3MBTL1CYP1A2CYP1A1
SCHEMBL5143349 0.83 ALDH1A1 (0.63) ALDH1A1MAOBL3MBTL1CYP1A2CYP1A1
Ethylene SCHEMBL4914414 0.82 ALDH1A1 (0.92) ALDH1A1L3MBTL1CYP1A2CYP1A1CYP1B1
Formaldehyde SCHEMBL28854145 0.82 ALDH1A1 (0.92) ALDH1A1L3MBTL1CYP1A2CYP1A1CYP1B1
SCHEMBL96291 0.82 ALDH1A1 (1.00) ALDH1A1L3MBTL1CYP1A2CYP1A1CYP1B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3921320-A1 IMIDAZO [2, 1-F] [1, 2, 4] TRIAZIN-4-AMINE DERIVATIVES AS TLR7 AGONIST BeiGene, Ltd. (KY) 2021-12-15 EP disclosed
CN-113454086-A Imidazo [2,1-F ] [1,2,4] triazin-4-amine derivatives as TLR7 agonists 百济神州有限公司 2021-09-28 CN disclosed
WO-2020160711-A1 IMIDAZO [2, 1-F] [1, 2, 4] TRIAZIN-4-AMINE DERIVATIVES AS TLR7 AGONIST BEIGENE, LTD. (KY) 2020-08-13 WO disclosed
EP-2305648-A1 Amide derivatives useful as glucokinase activators Novo Nordisk A/S (DK) 2011-04-06 EP disclosed
US-7244743-B2 Non-peptidic BRS-3 agonists SOLVAY PHARMACEUTICALS GMBH (DE) 2007-07-17 US disclosed
US-20050171146-A1 Non-peptidic BRS-3 agonists SOLVAY PHARMACEUTICALS GMBH (DE) 2005-08-04 US disclosed
EP-1458382-A1 AMIDE DERIVATIVES AS GK ACTIVATORS NOVO NORDISK A/S (DK) 2004-09-22 EP disclosed
EP-1336607-A1 Amide derivatives as glucokinase activators NOVO NORDISK A/S (DK) 2003-08-20 EP disclosed
WO-2003055482-A1 AMIDE DERIVATIVES AS GK ACTIVATORS NOVO NORDISK A/S (DK) 2003-07-10 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-20050171146-A1 Non-peptidic BRS-3 agonists BRS3, NPR3, ADRB3 ALDH1A1 3634/4885MAOB 2381/4885L3MBTL1 3655/4885

“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.