SCHEMBL17909488

SCHEMBL17909488

CCCCCOC(=O)CCCOCCOCCOC(C)C

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
DGKA P23743 1/20 0.51
NAAA Q02083 1/20 0.47
HTR2C P28335 1/20 0.46
PRSS1 P07477 1/20 0.46
PRSS2 P07478 1/20 0.46
PRSS3 P35030 1/20 0.46
MAPT P10636 2/20 0.45
LMNA P02545 3/20 0.45
DNM1 Q05193 1/20 0.44
EPHX2 P34913 2/20 0.42
TSHR P16473 1/20 0.41
RAD52 P43351 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
MEN1 O00255 1/20 0.41
THRB P10828 1/20 0.41
HTT P42858 1/20 0.41
KMT2A Q03164 1/20 0.41
FAAH O00519 1/20 0.41
ALDH1A1 P00352 1/20 0.41

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
SCHEMBL17909208 1.00 DGKA (0.51) DGKANAAAHTR2CPRSS1PRSS2
SCHEMBL17909495 0.98 DGKA (0.54) DGKANAAAHTR2CPRSS1PRSS2
SCHEMBL17908800 0.98 DGKA (0.54) DGKANAAAHTR2CPRSS1PRSS2
SCHEMBL17908753 0.98 DGKA (0.54) DGKANAAAHTR2CPRSS1PRSS2
SCHEMBL17909721 0.98 DGKA (0.54) DGKANAAAHTR2CPRSS1PRSS2
SCHEMBL17908637 0.98 DGKA (0.54) DGKANAAAHTR2CPRSS1PRSS2
SCHEMBL17909346 0.98 DGKA (0.54) DGKANAAAHTR2CPRSS1PRSS2
SCHEMBL17908823 0.98 DGKA (0.54) DGKANAAAHTR2CPRSS1PRSS2
SCHEMBL17908885 0.98 DGKA (0.54) DGKANAAAHTR2CPRSS1PRSS2
SCHEMBL17909685 0.98 DGKA (0.54) DGKANAAAHTR2CPRSS1PRSS2

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-3048093-B1 ETHER-CONTAINING MONOESTER COMPOUND AND USE THEREOF MORESCO CORP (JP) 2019-02-20 EP disclosed
US-10077229-B2 Ether-containing monoester compound and use thereof MORESCO CORPORATION (JP) 2018-09-18 US disclosed
EP-3048093-A1 ETHER-CONTAINING MONOESTER COMPOUND AND USE THEREOF Moresco Corporation (JP) 2016-07-27 EP disclosed
US-20160200998-A1 ETHER-CONTAINING MONOESTER COMPOUND AND USE THEREOF MORESCO CORPORATION (JP) 2016-07-14 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-10077229-B2 Ether-containing monoester compound and use thereof SFN, CCNE2, HSD3B2 DGKA 1202/4885NAAA 4428/4885HTR2C 875/4885
US-20160200998-A1 ETHER-CONTAINING MONOESTER COMPOUND AND USE THEREOF SFN, CCNE2, MSMO1 DGKA 1333/4885NAAA 4362/4885HTR2C 944/4885

“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.