SCHEMBL17401286

SCHEMBL17401286

CCCCCCCCCCCCCCC(=O)OCCN1CCCCC1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DGKA P23743 1/20 0.61
ALDH1A1 P00352 3/20 0.58
L3MBTL1 Q9Y468 3/20 0.58
THRB P10828 4/20 0.53
THRA P10827 2/20 0.53
DNM1 Q05193 1/20 0.51
LTA4H P09960 1/20 0.51
ESR1 P03372 2/20 0.51
LMNA P02545 2/20 0.50
CYP1A2 P05177 1/20 0.50
CHRM2 P08172 1/20 0.50
CHRM4 P08173 1/20 0.50
CHRM5 P08912 1/20 0.50
CYP2D6 P10635 1/20 0.50
CYP2C9 P11712 1/20 0.50
ADRA2C P18825 1/20 0.50
DRD4 P21917 1/20 0.50
ACHE P22303 1/20 0.50
SLC6A2 P23975 1/20 0.50
HRH2 P25021 1/20 0.50

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
SCHEMBL12120108 1.00 DGKA (0.61) DGKAALDH1A1L3MBTL1THRBTHRA
SCHEMBL17401287 1.00 DGKA (0.61) DGKAALDH1A1L3MBTL1THRBTHRA
SCHEMBL12120105 1.00 DGKA (0.61) DGKAALDH1A1L3MBTL1THRBTHRA
SCHEMBL12120109 1.00 DGKA (0.61) DGKAALDH1A1L3MBTL1THRBTHRA
SCHEMBL12120107 1.00 DGKA (0.61) DGKAALDH1A1L3MBTL1THRBTHRA
SCHEMBL23864897 1.00 DGKA (0.61) DGKAALDH1A1L3MBTL1THRBTHRA
SCHEMBL12120095 1.00 DGKA (0.61) DGKAALDH1A1L3MBTL1THRBTHRA
SCHEMBL17401288 1.00 DGKA (0.61) DGKAALDH1A1L3MBTL1THRBTHRA
SCHEMBL16541625 1.00 DGKA (0.61) DGKAALDH1A1L3MBTL1THRBTHRA
SCHEMBL12120094 0.98 DGKA (0.58) DGKAALDH1A1L3MBTL1THRBTHRA

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
US-9840479-B2 Polyamine-fatty acid derived lipidoids and uses thereof MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2017-12-12 US disclosed
US-9840479-B2 Polyamine-fatty acid derived lipidoids and uses thereof MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2017-12-12 US disclosed
WO-2016004202-A1 POLYAMINE-FATTY ACID DERIVED LIPIDOIDS AND USES THEREOF MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2016-01-07 WO disclosed
US-20160002178-A1 POLYAMINE-FATTY ACID DERIVED LIPIDOIDS AND USES THEREOF MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2016-01-07 US disclosed
US-20160002178-A1 POLYAMINE-FATTY ACID DERIVED LIPIDOIDS AND USES THEREOF MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2016-01-07 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 (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-20160002178-A1 POLYAMINE-FATTY ACID DERIVED LIPIDOIDS AND USES THEREOF SGMS2, SGMS1, ARG2 DGKA 117/4885ALDH1A1 2532/4885L3MBTL1 2105/4885

“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.