SCHEMBL4626306

SCHEMBL4626306

CO[C@H]1C[C@H](O)O[C@H](C)[C@H]1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
STAT3 P40763 7/20 0.49
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
GJA1 P17302 1/20 0.45
GJB2 P29033 1/20 0.45
CYP2C9 P11712 1/20 0.45
TSHR P16473 1/20 0.45
ALDH1A1 P00352 1/20 0.45
SYNJ2 O15056 1/20 0.44
LGALS8 O00214 1/20 0.44
LGALS3 P17931 1/20 0.44
LGALS4 P56470 1/20 0.44
AMY1A P0DUB6 1/20 0.44
LMNA P02545 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
SCHEMBL15948872 0.90 MEN1 (0.45) STAT3MEN1KMT2AGJA1GJB2
SCHEMBL12557317 0.90 MEN1 (0.45) STAT3MEN1KMT2AGJA1GJB2
SCHEMBL24737159 0.90 MEN1 (0.45) STAT3MEN1KMT2AGJA1GJB2
SCHEMBL14681085 0.85 STAT3 (0.42) STAT3MEN1KMT2AGJA1GJB2
SCHEMBL17368652 0.85 STAT3 (0.42) STAT3MEN1KMT2AGJA1GJB2
SCHEMBL13166654 0.83 SYNJ2 (0.51) STAT3MEN1KMT2AGJA1GJB2
SCHEMBL12556577 0.83 STAT3 (0.46) STAT3LGALS8LGALS3LGALS4
SCHEMBL12557233 0.83 STAT3 (0.46) STAT3LGALS8LGALS3LGALS4
SCHEMBL17368667 0.83 STAT3 (0.41) STAT3MEN1KMT2AGJA1GJB2
SCHEMBL10905061 0.81 AMY1A (0.57) STAT3MEN1KMT2AGJA1GJB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102154417-A Method for preparing periplocymarin UNIV TIANJIN TRADITIONAL CHINESE MEDICINE 2011-08-17 CN disclosed
EP-1605950-A4 NOVEL CHEMICAL ENTITIES AND METHODS FOR THEIR USE IN TREATMENT OF METABOLIC DISORDERS ACCERA INC (US) 2008-01-09 EP disclosed
US-20060189545-A1 Novel chemical entities and methods for their use in treatment of metabolic disorders ACCERA, INC. 2006-08-24 US disclosed
CN-1756554-A Novel chemical entities and methods for their use in the treatment of metabolic disorders ACCERA INC (US) 2006-04-05 CN disclosed
EP-1605950-A2 NOVEL CHEMICAL ENTITIES AND METHODS FOR THEIR USE IN TREATMENT OF METABOLIC DISORDERS Accera, Inc. (US) 2005-12-21 EP disclosed
WO-2004077938-A2 NOVEL CHEMICAL ENTITIES AND METHODS FOR THEIR USE IN TREATMENT OF METABOLIC DISORDERS ACCERA INC. (US) 2004-09-16 WO disclosed
US-6562514-B1 Stabilized vanadium electrolyte solutions for all-vanadium redox cells and batteries PINNACLE VRB LIMITED (AU) 2003-05-13 US disclosed
US-6468688-B2 CHARGING, DISCHARGING EFFICIENCY; VANADIUM ELECTROLYTE PINNACLE VRB LIMITED (AU) 2002-10-22 US disclosed
US-20010028977-A1 Charging, discharging efficiency; vanadium electrolyte JD HOLDING INC. (KY) 2001-10-11 US disclosed
US-6143443-A ALL-VANADIUM REDOX BATTERY, COMPRISING THE STABILIZED ELECTROLYTE PINNACLE ARB LIMITED (AU) 2000-11-07 US disclosed
EP-0829104-A1 HIGH ENERGY DENSITY VANADIUM ELECTROLYTE SOLUTIONS, METHODS OF PREPARATION THEREOF AND ALL-VANADIUM REDOX CELLS AND BATTERIES CONTAINING HIGH ENERGY VANADIUM ELECTROLYTE SOLUTIONS UNISEARCH LIMITED (AU) 1998-03-18 EP disclosed
EP-0729648-A4 STABILISED ELECTROLYTE SOLUTIONS, METHODS OF PREPARATION THEREOF AND REDOX CELLS AND BATTERIES CONTAINING STABILISED ELECTROLYTE SOLUTIONS UNISEARCH LTD (AU) 1997-01-02 EP disclosed
WO-1996035239-A1 HIGH ENERGY DENSITY VANADIUM ELECTROLYTE SOLUTIONS, METHODS OF PREPARATION THEREOF AND ALL-VANADIUM REDOX CELLS AND BATTERIES CONTAINING HIGH ENERGY VANADIUM ELECTROLYTE SOLUTIONS UNISEARCH LIMITED (AU) 1996-11-07 WO disclosed
EP-0729648-A1 STABILISED ELECTROLYTE SOLUTIONS, METHODS OF PREPARATION THEREOF AND REDOX CELLS AND BATTERIES CONTAINING STABILISED ELECTROLYTE SOLUTIONS UNISEARCH LIMITED (AU) 1996-09-04 EP disclosed
WO-1995012219-A1 STABILISED ELECTROLYTE SOLUTIONS, METHODS OF PREPARATION THEREOF AND REDOX CELLS AND BATTERIES CONTAINING STABILISED ELECTROLYTE SOLUTIONS UNISEARCH LIMITED (AU) 1995-05-04 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-20060189545-A1 Novel chemical entities and methods for their use in treatment of metabolic disorders BACE1, PC, PSEN2 STAT3 4804/4885MEN1 1409/4885KMT2A 713/4885

“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.