SCHEMBL2575268

SCHEMBL2575268

COc1cccc(OCc2ccccc2)c1CO

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.56
MAPT P10636 1/20 0.56
MAPK1 P28482 1/20 0.56
TDP1 Q9NUW8 1/20 0.56
HTR1A P08908 5/20 0.53
ADRA1D P25100 4/20 0.53
ADRA1A P35348 4/20 0.53
ADRA1B P35368 4/20 0.53
RXRA P19793 1/20 0.53
MRGPRX4 Q96LA9 1/20 0.52
LIPE Q05469 1/20 0.51
ATM Q13315 1/20 0.51
APP P05067 1/20 0.50
KDM4E B2RXH2 1/20 0.49
ABCB1 P08183 3/20 0.48
DRD2 P14416 1/20 0.48
BCHE P06276 1/20 0.48
MAOB P27338 1/20 0.47
ATP4A P20648 1/20 0.47
ATP4B P51164 1/20 0.47

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
SCHEMBL3920602 0.91 MAPT (0.60) L3MBTL1MAPTMAPK1TDP1HTR1A
SCHEMBL6034660 0.83 RXRA (0.56) L3MBTL1MAPTMAPK1TDP1HTR1A
SCHEMBL21957670 0.82 MAOB (0.54) L3MBTL1MAPTMAPK1TDP1HTR1A
SCHEMBL505777 0.82 CA1 (0.50) L3MBTL1MAPTMAPK1KDM4EHPGD
SCHEMBL9302604 0.81 HTR1A (0.54) L3MBTL1MAPTMAPK1TDP1HTR1A
SCHEMBL6184739 0.80 MAPT (0.51) L3MBTL1MAPTMAPK1TDP1HTR1A
SCHEMBL695445 0.80 HPGD (0.53) L3MBTL1MAPTMAPK1TDP1HTR1A
SCHEMBL30416387 0.80 HTR1A (0.74) L3MBTL1MAPTMAPK1TDP1HTR1A
SCHEMBL791853 0.80 HTR1A (0.74) L3MBTL1MAPTMAPK1TDP1HTR1A
SCHEMBL6036331 0.80 MAPK1 (0.51) L3MBTL1MAPTMAPK1TDP1HTR1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8048897-B2 Cyclohexane derivative, prodrug thereof and salt thereof, and therapeutic agent containing the same for diabetes CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2011-11-01 US disclosed
US-20080318874-A1 Novel Cyclohexane Derivative, Prodrug Thereof and Salt Thereof, and Therapeutic Agent Containing the Same for Diabetes CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2008-12-25 US disclosed
EP-1783110-A1 NOVEL CYCLOHEXANE DERIVATIVE, PRODRUG THEREOF AND SALT THEREOF, AND THERAPEUTIC AGENT CONTAINING THE SAME FOR DIABETES CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2007-05-09 EP disclosed
US-20060148858-A1 1, 2-Azole derivatives with hypoglycemic and hypolipidemic activity TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2006-07-06 US disclosed
EP-1513817-A1 1, 2-AZOLE DERIVATIVES WITH HYPOGLYCEMIC AND HYPOLIPIDEMIC ACTIVITY Takeda Pharmaceutical Company Limited (JP) 2005-03-16 EP disclosed
WO-2003099793-A9 1,2-AZOLE DERIVATIVES WITH HYPOGLYCEMIC AND HYPOLIPIDEMIC ACTIVITY TAKEDA PHARMACEUTICAL (JP) 2005-02-10 WO disclosed
WO-2003099793-A1 1,2-AZOLE DERIVATIVES WITH HYPOGLYCEMIC AND HYPOLIPIDEMIC ACTIVITY TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2003-12-04 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 (2 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-20060148858-A1 1, 2-Azole derivatives with hypoglycemic and hypolipidemic activity GPR119, SLC5A1, CYP4B1 L3MBTL1 1040/4885MAPT 4741/4885MAPK1 717/4885
US-20080318874-A1 Novel Cyclohexane Derivative, Prodrug Thereof and Salt Thereof, and Therapeutic Agent Containing the Same for Diabetes SLC5A1, GPR119, SLC5A2 L3MBTL1 1828/4885MAPT 4638/4885MAPK1 119/4885

“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.