SCHEMBL1760794

SCHEMBL1760794

O=C(O)CCC(O)c1cccc(OCc2c(O)cccc2O)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
CYSLTR2 Q9NS75 6/20 0.43
CYSLTR1 Q9Y271 6/20 0.43
MAPK1 P28482 2/20 0.40
TP53 P04637 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2C9 P11712 1/20 0.40
TSHR P16473 1/20 0.40
NFKB1 P19838 1/20 0.40
CYP2C19 P33261 1/20 0.40
HIF1A Q16665 1/20 0.40
MEN1 O00255 1/20 0.40
GMNN O75496 1/20 0.40
ALDH1A1 P00352 1/20 0.40
LMNA P02545 1/20 0.40
ALOX5 P09917 1/20 0.40
HPGD P15428 1/20 0.40
PTGS1 P23219 1/20 0.40

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
SCHEMBL21205744 0.86 KMT2A (0.43) KMT2ASMN1; SMN2CYSLTR2CYSLTR1
SCHEMBL1007881 0.86 SLC22A12 (0.44) KMT2ASMN1; SMN2CYSLTR2CYSLTR1
SCHEMBL957166 0.86 SLC22A12 (0.44) KMT2ASMN1; SMN2CYSLTR2CYSLTR1
SCHEMBL11436469 0.78 L3MBTL1 (0.62) LMNA
SCHEMBL11436413 0.78 L3MBTL1 (0.62) LMNA
SCHEMBL11436414 0.78 L3MBTL1 (0.62) LMNA
SCHEMBL10635784 0.76 CYSLTR1 (0.74) KMT2ASMN1; SMN2CYSLTR2CYSLTR1MAPK1
SCHEMBL2185411 0.75 MAPK1 (0.41) KMT2ASMN1; SMN2CYSLTR2CYSLTR1MAPK1
SCHEMBL19291551 0.75 OPRK1 (0.42) KMT2ASMN1; SMN2CYSLTR2CYSLTR1MAPK1
SCHEMBL1760752 0.75 HPGD (0.48) CYP1A2CYP2C19ALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7947735-B2 Compounds for the treatment of metabolic disorders WELLSTAT THERAPEUTICS CORPORATION (US) 2011-05-24 US claimed
CN-101374415-A Compounds for the treatment of metabolic disorders WELLSTAT THERAPEUTICS CORP (US) 2009-02-25 CN claimed
US-20080306150-A1 Compounds for the Treatment of Metabolic Disorders WELLSTAT THERAPEUTICS CORPORATION (US) 2008-12-11 US claimed
EP-1976378-A2 COMPOUNDS FOR THE TREATMENT OF METABOLIC DISORDERS Wellstat Therapeutics Corporation (US) 2008-10-08 EP claimed
WO-2007087506-A2 COMPOUNDS FOR THE TREATMENT OF METABOLIC DISORDERS WELLSTAT THERAPEUTICS CORPORATION (US) 2007-08-02 WO claimed
US-7947735-B2 Compounds for the treatment of metabolic disorders WELLSTAT THERAPEUTICS CORPORATION (US) 2011-05-24 US disclosed
CN-101374415-A Compounds for the treatment of metabolic disorders WELLSTAT THERAPEUTICS CORP (US) 2009-02-25 CN disclosed
US-20080306150-A1 Compounds for the Treatment of Metabolic Disorders WELLSTAT THERAPEUTICS CORPORATION (US) 2008-12-11 US disclosed
EP-1976378-A2 COMPOUNDS FOR THE TREATMENT OF METABOLIC DISORDERS Wellstat Therapeutics Corporation (US) 2008-10-08 EP disclosed
WO-2007087506-A2 COMPOUNDS FOR THE TREATMENT OF METABOLIC DISORDERS WELLSTAT THERAPEUTICS CORPORATION (US) 2007-08-02 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-20080306150-A1 Compounds for the Treatment of Metabolic Disorders GPR119, FABP1, CPT1B KMT2A 2650/4885SMN1; SMN2 2328/4885CYSLTR2 4315/4885

“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.