SCHEMBL3513091

SCHEMBL3513091

O=[C]CN(CCO)CCO

nearest known ligand 0.36

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.36
KDM4E B2RXH2 1/20 0.36
ALOX15 P16050 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36

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
SCHEMBL10655388 0.94 MAPT (0.36) MAPTKDM4EALOX15SMN1; SMN2
SCHEMBL5730528 0.85
SCHEMBL5729906 0.83 TSHR (0.30)
SCHEMBL8661196 0.75 MAPT (0.35) MAPTKDM4EALOX15SMN1; SMN2
SCHEMBL5965358 0.74
SCHEMBL2139630 0.73
Trolamine SCHEMBL11688308 0.73 MAPT (0.37) MAPTKDM4EALOX15SMN1; SMN2
SCHEMBL1461493 0.73 CA12 (0.36) KDM4E
SCHEMBL2575881 0.72
SCHEMBL64496 0.71 CYP1A2 (0.44) MAPTKDM4EALOX15SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117820258-A Corrosion inhibitor and preparation method and application thereof 深圳飞扬骏研新材料股份有限公司 2024-04-05 CN claimed
CN-117820258-A Corrosion inhibitor and preparation method and application thereof 深圳飞扬骏研新材料股份有限公司 2024-04-05 CN disclosed
US-8980242-B2 Aliphatic prodrug linker ASCENDIS PHARMA GMBH (DK) 2015-03-17 US disclosed
US-20100291021-A1 ALIPHATIC PRODRUG LINKER ASCENDIS PHARMA GMBH (DE) 2010-11-18 US disclosed
US-7332515-B2 Indole-amid derivatives which possess glycogen phosphorylase inhibitory activity ASTRAZENECA AB (SE) 2008-02-19 US disclosed
US-20070123528-A1 INDOLE-AMID DERIVATIVES WHICH POSSESS GLYCOGEN PHOSPHORYLASE INHIBITORY ACTIVITY ASTRAZENECA AB (SE) 2007-05-31 US disclosed
US-7166636-B2 Type 2 diabetes, insulin resistance, syndrome X, hyperinsulinemia, or hyperglucagonemia; methyl (S)-5-{1-[(5-chloro-1H-indol-2-ylcarbonyl)amino]-2-phenylethyl}oxazole-4-carboxylate; amidation by reacting the 2-carboxyindole and a 1,2-diphenylethylamine ASTRAZENECA AB (SE) 2007-01-23 US disclosed
EP-1483271-B1 HETEROCYCLIC AMIDE DERIVATIVES HAVING GLYCOGEN PHOSPHORYLASE INHIBITORY ACTIVITY ASTRAZENECA AB (SE) 2006-11-22 EP disclosed
US-7138415-B2 Indolamid derivatives which possess glycogenphosphorylase inhibitory activity ASTRAZENECA AB (SE) 2006-11-21 US disclosed
US-7122567-B2 Heterocyclic amide derivatives having glycogen phosphorylase inhibitory activity ASTRAZENECA AB (SE) 2006-10-17 US disclosed
US-20050131052-A1 Heterocyclic amide derivatives having glycogen phosphorylase inhibitory activity ASTRAZENECA AB (SE) 2005-06-16 US disclosed
US-20050130963-A1 Indole-amid derivatives which possess glycogen phosphorylase inhibitory activity ASTRAZENECA AB (SE) 2005-06-16 US disclosed
US-20050107362-A1 Indolamid derivatives which possess glycogenphosphorylase inhibitory activity ASTRA ZENECA AB (SE) 2005-05-19 US disclosed
EP-1492788-A1 INDOLE-AMID DERIVATIVES WHICH POSSESS GLYCOGEN PHOSPHORYLASE INHIBITORY ACTIVITY AstraZeneca AB (SE) 2005-01-05 EP disclosed
EP-1483240-A1 INDOLAMID DERIVATIVES WHICH POSSESS GLYCOGEN PHOSPHORYLASE INHIBITORY ACTIVITY AstraZeneca AB (SE) 2004-12-08 EP disclosed
EP-1483271-A1 HETEROCYCLIC AMIDE DERIVATIVES HAVING GLYCOGEN PHOSPHORYLASE INHIBITORY ACTIVITY Astrazeneca AB (SE) 2004-12-08 EP disclosed
WO-2003074517-A1 INDOLE-AMID DERIVATIVES WHICH POSSESS GLYCOGEN PHOSPHORYLASE INHIBITORY ACTIVITY ASTRAZENECA AB (SE) 2003-09-12 WO disclosed
WO-2003074531-A1 HETEROCYCLIC AMIDE DERIVATIVES HAVING GLYCOGEN PHOSPHORYLASE INHIBITORY ACTIVITY ASTRAZENECA AB (SE) 2003-09-12 WO disclosed
WO-2003074484-A1 INDOLAMID DERIVATIVES WHICH POSSESS GLYCOGENPHOSPHORYLASE INHIBITORY ACTIVITY ASTRAZENECA AB (SE) 2003-09-12 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 (5 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-20050107362-A1 Indolamid derivatives which possess glycogenphosphorylase inhibitory activity PYGL, PYGM, PYGB MAPT 3484/4885KDM4E 3404/4885ALOX15 4292/4885
US-20050130963-A1 Indole-amid derivatives which possess glycogen phosphorylase inhibitory activity GYS1, PYGL, GYS2 MAPT 2918/4885KDM4E 3065/4885ALOX15 1985/4885
US-20100291021-A1 ALIPHATIC PRODRUG LINKER PAICS, AADAC, TK1 MAPT 986/4885KDM4E 2936/4885ALOX15 2151/4885
US-20070123528-A1 INDOLE-AMID DERIVATIVES WHICH POSSESS GLYCOGEN PHOSPHORYLASE INHIBITORY ACTIVITY PYGL, PYGM, PYGB MAPT 886/4885KDM4E 1586/4885ALOX15 2373/4885
US-20050131052-A1 Heterocyclic amide derivatives having glycogen phosphorylase inhibitory activity PYGL, GYS1, CBR3 MAPT 3821/4885KDM4E 3240/4885ALOX15 4280/4885

“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.