SCHEMBL20562145

SCHEMBL20562145

CCOc1cc(B2OC(C)(C)C(C)(C)O2)cc(C)c1C(=O)OC

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.38
HIF1A Q16665 3/20 0.38
TSHR P16473 1/20 0.37
MAPK1 P28482 1/20 0.37
DGAT1 O75907 1/20 0.37
CYP3A4 P08684 2/20 0.35
ACHE P22303 1/20 0.35
KMT2A Q03164 2/20 0.35
AAK1 Q2M2I8 2/20 0.35
TDP1 Q9NUW8 1/20 0.34
GSK3A P49840 1/20 0.34
GSK3B P49841 1/20 0.34
HPGD P15428 1/20 0.34
POLB P06746 1/20 0.34
ALDH1A1 P00352 2/20 0.34
TAS1R3 Q7RTX0 1/20 0.34
TAS1R1 Q7RTX1 1/20 0.34
HTT P42858 1/20 0.34
UCHL1 P09936 1/20 0.34
MEN1 O00255 1/20 0.33

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
SCHEMBL20564345 0.89 HIF1A (0.38) GAAHIF1ATSHRMAPK1DGAT1
SCHEMBL20505519 0.87 HIF1A (0.35) HIF1ATSHRDGAT1AAK1GSK3A
SCHEMBL23162299 0.87 CYP3A4 (0.40) GAAHIF1ADGAT1CYP3A4ACHE
SCHEMBL20556209 0.80 CYP3A4 (0.40) GAAHIF1ATSHRDGAT1CYP3A4
SCHEMBL18241400 0.79 TDP1 (0.39) GAAHIF1ATSHRMAPK1DGAT1
SCHEMBL424243 0.79 TDP1 (0.52) HIF1ATSHRDGAT1CYP3A4KMT2A
SCHEMBL20505549 0.79 AAK1 (0.39) GAAHIF1ATSHRDGAT1KMT2A
SCHEMBL22491269 0.78 CSF1R (0.38) GAAHIF1ADGAT1CYP3A4AAK1
SCHEMBL20504692 0.77 HIF1A (0.36) HIF1ATSHRDGAT1CYP3A4AAK1
SCHEMBL20504858 0.76 ROCK1 (0.38) GAAHIF1ATSHRDGAT1AAK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3625227-B1 BENZOFURANE AND BENZOTHIOPHENE DERIVATIVES AS PGE2 RECEPTOR MODULATORS IDORSIA PHARMACEUTICALS LTD (CH) 2022-09-14 EP disclosed
US-11325899-B2 Benzofurane and benzothiophene derivatives as PGE2 receptor modulators IDORSIA PHARMACEUTICALS LTD (CH) 2022-05-10 US disclosed
US-20210115031-A1 BENZOFURANE AND BENZOTHIOPHENE DERIVATIVES AS PGE2 RECEPTOR MODULATORS IDORSIA PHARMACEUTICALS LTD (CH) 2021-04-22 US disclosed
EP-3625227-A1 BENZOFURANE AND BENZOTHIOPHENE DERIVATIVES AS PGE2 RECEPTOR MODULATORS Idorsia Pharmaceuticals Ltd (CH) 2020-03-25 EP disclosed
WO-2018210987-A1 BENZOFURANE AND BENZOTHIOPHENE DERIVATIVES AS PGE2 RECEPTOR MODULATORS IDORSIA PHARMACEUTICALS LTD (CH) 2018-11-22 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-20210115031-A1 BENZOFURANE AND BENZOTHIOPHENE DERIVATIVES AS PGE2 RECEPTOR MODULATORS PTGER4, PTGER1, PTGER2 GAA 4870/4885HIF1A 1035/4885TSHR 704/4885
US-11325899-B2 Benzofurane and benzothiophene derivatives as PGE2 receptor modulators PTGER4, PTGER1, PTGER2 GAA 4870/4885HIF1A 1035/4885TSHR 704/4885

“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.