SCHEMBL13014736

SCHEMBL13014736

CCOCCNC(=O)COCC(C)=O

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.43
▸ CES2 O00748 1/20 0.40
▸ EPHX2 P34913 1/20 0.40
▸ TSHR P16473 3/20 0.39
▸ THRB P10828 1/20 0.39
▸ FAAH O00519 1/20 0.39
▸ HSD17B10 Q99714 2/20 0.38
▸ CASP1 P29466 1/20 0.38
▸ CASP7 P55210 1/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ NAMPT P43490 1/20 0.37
▸ HTT P42858 1/20 0.36
▸ HPGD P15428 2/20 0.35
▸ PCNA P12004 1/20 0.35
▸ MEN1 O00255 1/20 0.35
▸ KMT2A Q03164 1/20 0.35

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
SCHEMBL12733551 0.96 ALDH1A1 (0.41) ALDH1A1CES2EPHX2TSHRTHRB
SCHEMBL11928874 0.96 ALDH1A1 (0.41) ALDH1A1CES2EPHX2TSHRTHRB
SCHEMBL13113388 0.93 CES2 (0.42) ALDH1A1CES2EPHX2TSHRTHRB
SCHEMBL72044 0.89 CES2 (0.42) ALDH1A1CES2EPHX2TSHRTHRB
SCHEMBL25028599 0.89 ALDH1A1 (0.39) ALDH1A1CES2EPHX2TSHRTHRB
SCHEMBL23677003 0.88 ALDH1A1 (0.47) ALDH1A1EPHX2TSHRTHRBFAAH
SCHEMBL253658 0.87 CES2 (0.43) ALDH1A1CES2EPHX2TSHRFAAH
SCHEMBL15335399 0.87 MEN1 (0.45) ALDH1A1CES2TSHRFAAHMEN1
SCHEMBL26376485 0.86 CES2 (0.44) ALDH1A1CES2TSHRFAAHSMN1; SMN2
SCHEMBL13154532 0.86 CES2 (0.42) ALDH1A1CES2EPHX2TSHRFAAH

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-2611420-B1 LIPIDS SUITABLE FOR LIPOSOMAL DELIVERY OF PROTEIN-CODING RNA GLAXOSMITHKLINE BIOLOGICALS SA (BE) 2019-03-27 — — EP disclosed
US-20130189351-A1 LIPIDS SUITABLE FOR LIPOSOMAL DELIVERY OF PROTEIN CODING RNA NOVARTIS AG (CH) 2013-07-25 — — US disclosed
US-8415510-B2 Synthesis of a PEG-6 moiety from commercial low-cost chemicals GE HEALTHCARE LIMITED (GB) 2013-04-09 — — US disclosed
US-20100324264-A1 SYNTHESIS OF A PEG-6 MOIETY FROM COMMERCIAL LOW-COST CHEMICALS GE HEALTHCARE LIMITED (GB) 2010-12-23 — — US 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-20130189351-A1 LIPIDS SUITABLE FOR LIPOSOMAL DELIVERY OF PROTEIN CODING RNA NSUN3, RNMT, AGO2 ALDH1A1 4665/4885CES2 3635/4885EPHX2 3551/4885
US-20100324264-A1 SYNTHESIS OF A PEG-6 MOIETY FROM COMMERCIAL LOW-COST CHEMICALS GAS6, LNPEP, BMP6 ALDH1A1 3799/4885CES2 814/4885EPHX2 501/4885

“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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