SCHEMBL20564150

SCHEMBL20564150

CCOC(=O)COc1cc(Br)c(OC)cc1C=O

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 8/20 0.64
▸ CYP1A2 P05177 2/20 0.64
▸ CYP2C19 P33261 2/20 0.64
▸ MAPT P10636 5/20 0.54
▸ GAA P10253 2/20 0.54
▸ PRNP P04156 1/20 0.54
▸ ALOX12 P18054 1/20 0.54
▸ LMNA P02545 4/20 0.49
▸ PRKDC P78527 1/20 0.49
▸ PTPN1 P18031 1/20 0.47
▸ L3MBTL1 Q9Y468 3/20 0.46
▸ TSHR P16473 1/20 0.46
▸ HPGD P15428 2/20 0.44
▸ SMN1; SMN2 Q16637 1/20 0.44
▸ STING1 Q86WV6 2/20 0.44
▸ USP2 O75604 1/20 0.43
▸ CYP3A4 P08684 1/20 0.43
▸ CYP2C9 P11712 1/20 0.43
▸ NTSR1 P30989 1/20 0.43
▸ NPSR1 Q6W5P4 1/20 0.43

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
SCHEMBL20563891 0.95 ALDH1A1 (0.64) ALDH1A1CYP1A2CYP2C19MAPTGAA
SCHEMBL4763180 0.89 ALDH1A1 (0.62) ALDH1A1CYP1A2CYP2C19MAPTGAA
SCHEMBL28941187 0.84 ALDH1A1 (0.57) ALDH1A1CYP1A2CYP2C19MAPTGAA
SCHEMBL20563979 0.83 PTGDR2 (0.58) ALDH1A1CYP1A2CYP2C19MAPTGAA
SCHEMBL23783245 0.83 LMNA (0.70) ALDH1A1CYP1A2CYP2C19MAPTLMNA
SCHEMBL13996357 0.80 LMNA (0.45) ALDH1A1CYP1A2CYP2C19MAPTGAA
SCHEMBL14001409 0.80 LMNA (0.45) ALDH1A1CYP1A2CYP2C19MAPTGAA
SCHEMBL6818074 0.79 ALDH1A1 (0.70) ALDH1A1CYP1A2CYP2C19MAPTGAA
SCHEMBL29145029 0.78 ALDH1A1 (0.63) ALDH1A1CYP1A2CYP2C19MAPTGAA
SCHEMBL1991262 0.78 PTGDR2 (0.68) ALDH1A1CYP1A2CYP2C19MAPTLMNA

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
WO-2024182747-A2 COMPOUNDS AND METHODS FOR MODULATING SPLICING REMIX THERAPEUTICS INC. (US) 2024-09-06 — — WO disclosed
US-11839613-B2 Pyrimidine derivatives as PGE2 receptor modulators IDORSIA PHARMACEUTICALS LTD (CH) 2023-12-12 — — US disclosed
EP-3625228-B1 PYRIMIDINE DERIVATIVES AS PGE2 RECEPTOR MODULATORS IDORSIA PHARMACEUTICALS LTD (CH) 2021-07-07 — — EP disclosed
US-20210113559-A1 PYRIMIDINE DERIVATIVES AS PGE2 RECEPTOR MODULATORS IDORSIA PHARMACEUTICALS LTD (CH) 2021-04-22 — — US disclosed
EP-3625228-A1 PYRIMIDINE DERIVATIVES AS PGE2 RECEPTOR MODULATORS Idorsia Pharmaceuticals Ltd (CH) 2020-03-25 — — EP disclosed
CN-110612299-A Pyrimidine derivatives as PGE2 receptor modulators 爱杜西亚药品有限公司 2019-12-24 — — CN disclosed
WO-2018210988-A1 PYRIMIDINE 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-11839613-B2 Pyrimidine derivatives as PGE2 receptor modulators PTGER1, PTGER4, PTGER2 ALDH1A1 468/4885CYP1A2 124/4885CYP2C19 197/4885
US-20210113559-A1 PYRIMIDINE DERIVATIVES AS PGE2 RECEPTOR MODULATORS PTGER1, PTGER4, PTGER2 ALDH1A1 468/4885CYP1A2 124/4885CYP2C19 197/4885

“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.

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