SCHEMBL1551617

SCHEMBL1551617

CCOC(=O)COc1ccc(C#Cc2ccc(CO)cc2)cc1

nearest known ligand 0.60

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.56
NPSR1 Q6W5P4 1/20 0.56
KDM4E B2RXH2 2/20 0.47
HSD17B10 Q99714 2/20 0.47
ALDH1A1 P00352 1/20 0.47
TP53 P04637 1/20 0.47
MAPT P10636 1/20 0.47
HPGD P15428 1/20 0.47
ACACB O00763 4/20 0.47
FFAR1 O14842 3/20 0.46
POLB P06746 1/20 0.46
TSHR P16473 1/20 0.45
TBXAS1 P24557 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45

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
SCHEMBL8321862 0.92 GAA (0.64) GAANPSR1KDM4EHSD17B10ALDH1A1
SCHEMBL12646489 0.88 GAA (0.59) GAANPSR1KDM4EHSD17B10ALDH1A1
SCHEMBL1550768 0.86 GAA (0.60) GAANPSR1KDM4EHSD17B10ALDH1A1
SCHEMBL1550947 0.85 FFAR1 (0.66) GAANPSR1KDM4EHSD17B10ALDH1A1
SCHEMBL1550341 0.85 GAA (0.59) GAANPSR1KDM4EHSD17B10ALDH1A1
SCHEMBL5202817 0.81 GAA (0.66) GAANPSR1KDM4EHSD17B10ALDH1A1
SCHEMBL6375038 0.80 CYP4F2 (0.66) GAANPSR1KDM4EHSD17B10ALDH1A1
SCHEMBL1551092 0.80 FFAR1 (0.72) ALDH1A1MAPTFFAR1TBXAS1SMN1; SMN2
SCHEMBL1550806 0.79 FFAR1 (0.73) GAANPSR1KDM4EHSD17B10ALDH1A1
SCHEMBL1550405 0.79 FFAR1 (0.73) GAANPSR1KDM4EHSD17B10ALDH1A1

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
US-8586607-B2 Compounds for the treatment of metabolic diseases SYDDANSK UNIVERSITET (DK) 2013-11-19 US disclosed
US-8586607-B2 Compounds for the treatment of metabolic diseases SYDDANSK UNIVERSITET (DK) 2013-11-19 US disclosed
EP-2313360-B1 COMPOUNDS FOR THE TREATMENT OF METABOLIC DISEASES UNIV SYDDANSK (DK) 2012-09-05 EP disclosed
EP-2313360-B1 COMPOUNDS FOR THE TREATMENT OF METABOLIC DISEASES UNIV SYDDANSK (DK) 2012-09-05 EP disclosed
US-20110152315-A1 COMPOUNDS FOR THE TREATMENT OF METABOLIC DISEASES SYDDANSK UNIVERSITET 2011-06-23 US disclosed
US-20110152315-A1 COMPOUNDS FOR THE TREATMENT OF METABOLIC DISEASES SYDDANSK UNIVERSITET 2011-06-23 US disclosed
EP-2313360-A1 COMPOUNDS FOR THE TREATMENT OF METABOLIC DISEASES Syddansk Universitet (DK) 2011-04-27 EP disclosed
WO-2010012650-A1 COMPOUNDS FOR THE TREATMENT OF METABOLIC DISEASES SYDDANSK UNIVERSITET (DK) 2010-02-04 WO disclosed
WO-2010012650-A1 COMPOUNDS FOR THE TREATMENT OF METABOLIC DISEASES SYDDANSK UNIVERSITET (DK) 2010-02-04 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-20110152315-A1 COMPOUNDS FOR THE TREATMENT OF METABOLIC DISEASES GPR119, INSR, GPR65 GAA 663/4885NPSR1 460/4885KDM4E 2568/4885

“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.