SCHEMBL6556916

SCHEMBL6556916

O=C(O)CCCCC(O)(O)O

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.61
TSHR P16473 5/20 0.58
NFKB1 P19838 2/20 0.58
PMP22 Q01453 1/20 0.58
SLC22A6 Q4U2R8 2/20 0.53
GPR84 Q9NQS5 5/20 0.48
FFAR1 O14842 2/20 0.48
FFAR4 Q5NUL3 2/20 0.48
AKR1B1 P15121 1/20 0.48
CYP2D6 P10635 1/20 0.48
FOLH1 Q04609 1/20 0.48
PPARG P37231 6/20 0.46
PPARD Q03181 6/20 0.46
PPARA Q07869 6/20 0.46
HDAC11 Q96DB2 5/20 0.46
ALDH1A1 P00352 3/20 0.46
TLR2 O60603 2/20 0.46
TDP1 Q9NUW8 2/20 0.46
MEN1 O00255 2/20 0.46
FABP4 P15090 2/20 0.46

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
SCHEMBL6542235 0.97 TSHR (0.63) LMNATSHRNFKB1PMP22SLC22A6
SCHEMBL20495315 0.97 TSHR (0.63) LMNATSHRNFKB1PMP22SLC22A6
SCHEMBL23727589 0.97 TSHR (0.63) LMNATSHRNFKB1PMP22SLC22A6
SCHEMBL31095029 0.97 TSHR (0.63) LMNATSHRNFKB1PMP22SLC22A6
SCHEMBL2784985 0.92 LMNA (0.56) LMNATSHRNFKB1PMP22SLC22A6
Sulfuric Acid SCHEMBL31732373 0.89 TSHR (0.52) LMNATSHRNFKB1PMP22SLC22A6
Stearic Acid SCHEMBL30332067 0.82 GPR84 (0.71) LMNATSHRSLC22A6GPR84FFAR1
Adipic Acid SCHEMBL4369555 0.82 LMNA (0.92) LMNATSHRNFKB1PMP22SLC22A6
SCHEMBL20551232 0.82 FASN (0.62) LMNAPPARGPPARDPPARATDP1
SCHEMBL1712383 0.79

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140350269-A1 Acetals Esters Produced from Purified Glycerin for Use and Application as Emollients, Lubricants, Plasticizers, Solvents, Coalescents, Humectant, Polymerization Monomers, Additives to Biofuels GLYCEROSOLUTION QUÍMICA LTDA. (BR) 2014-11-27 US claimed
EP-2799433-A2 Acetals esters produced from purified glycerin for use and application as emollients, lubricants, plasticizers, solvents, coalescents, humectant, polymerization monomers, additives to biofuels Glycerosolution Quimica, Ltda (BR) 2014-11-05 EP claimed
EP-1184380-B1 Ammonium 3,5,6-trihydroxyhexanoate derivatives and preparation process thereof TAKASAGO PERFUMERY CO LTD (JP) 2004-02-25 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-20140350269-A1 Acetals Esters Produced from Purified Glycerin for Use and Application as Emollients, Lubricants, Plasticizers, Solvents, Coalescents, Humectant, Polymerization Monomers, Additives to Biofuels GK, DAGLA, DAGLB LMNA 1568/4885TSHR 4736/4885NFKB1 4765/4885

“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.