SCHEMBL1900469

SCHEMBL1900469

O=C(CCS)OCC(COC(=O)CCS)(COC(=O)CCS)COC(=O)CCS.O=C(CCS)OCC(COC(=O)CCS)(COC(=O)CCS)COC(=O)CCS

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.34
HIF1A Q16665 2/20 0.34
ACE P12821 2/20 0.32
ALDH1A1 P00352 1/20 0.31
TP53 P04637 1/20 0.31
CYP3A4 P08684 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
ADRA2A P08913 1/20 0.30
ADRA1A P35348 1/20 0.30

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
SCHEMBL56208 1.00 MAPK1 (0.34) MAPK1HIF1AACEALDH1A1TP53
SCHEMBL12815337 0.93 TSHR (0.36) MAPK1HIF1A
SCHEMBL16569418 0.93 MAPK1 (0.32) MAPK1HIF1AALDH1A1TP53CYP3A4
SCHEMBL99517 0.93 MAPK1 (0.31) MAPK1HIF1A
SCHEMBL16800392 0.93 TSHR (0.36) MAPK1HIF1A
SCHEMBL29365358 0.93 MAPK1 (0.31) MAPK1HIF1A
SCHEMBL13239258 0.93 TSHR (0.36) MAPK1HIF1A
SCHEMBL574354 0.93 TSHR (0.36) MAPK1HIF1A
SCHEMBL25092946 0.91 MAPK1 (0.31) MAPK1HIF1AALDH1A1TP53CYP3A4
SCHEMBL13734765 0.89 ALDH1A1 (0.34) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2325231-B1 MULTIBRANCHED POLYALKYLENE GLYCOL POLYMER AND MANUFACTURING METHOD THEREOF, AND CEMENT ADMIXTURE NIPPON CATALYTIC CHEM IND (JP) 2019-11-06 EP disclosed
US-8476341-B2 Multi-branched polyalkylene glycol polymer, method for producing the same, and admixture for cement NIPPON SHOKUBAI CO., LTD. (JP) 2013-07-02 US disclosed
US-20110160393-A1 MULTI-BRANCHED POLYALKYLENE GLYCOL POLYMER, METHOD FOR PRODUCING THE SAME, AND ADMIXTURE FOR CEMENT NIPPON SHOKUBAI CO., LTD. (JP) 2011-06-30 US disclosed
EP-2325231-A1 MULTIBRANCHED POLYALKYLENE GLYCOL POLYMER AND MANUFACTURING METHOD THEREOF, AND CEMENT ADMIXTURE Nippon Shokubai Co., Ltd. (JP) 2011-05-25 EP 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-20110160393-A1 MULTI-BRANCHED POLYALKYLENE GLYCOL POLYMER, METHOD FOR PRODUCING THE SAME, AND ADMIXTURE FOR CEMENT VCL, XRCC5, BCR MAPK1 2606/4885HIF1A 3901/4885ACE 3682/4885

“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.