SCHEMBL4394675

SCHEMBL4394675

COC(=O)OC(C)OC(=O)C(CCCCC(=O)O)C(C)OC(=O)OC

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.36
ALDH1A1 P00352 2/20 0.35
FFAR4 Q5NUL3 1/20 0.35
FFAR1 O14842 1/20 0.35
KDM4C Q9H3R0 2/20 0.34
KDM4A O75164 1/20 0.34
PHF8 Q9UPP1 1/20 0.34
KDM2A Q9Y2K7 1/20 0.34
GSTK1 Q9Y2Q3 2/20 0.33
ADRA1A P35348 1/20 0.33
BHMT Q93088 2/20 0.33
ENPEP Q07075 1/20 0.33
LMNA P02545 2/20 0.32
AKR1B1 P15121 1/20 0.32
NFKB1 P19838 1/20 0.31
PMP22 Q01453 1/20 0.31

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
SCHEMBL4388239 0.99 ALDH1A1 (0.38) TSHRALDH1A1FFAR4FFAR1KDM4C
SCHEMBL4388242 0.99 ALDH1A1 (0.38) TSHRALDH1A1FFAR4FFAR1KDM4C
SCHEMBL4386107 0.99 ALDH1A1 (0.38) TSHRALDH1A1FFAR4FFAR1KDM4C
SCHEMBL4395469 0.99 ALDH1A1 (0.38) TSHRALDH1A1FFAR4FFAR1KDM4C
SCHEMBL4384284 0.99 ALDH1A1 (0.38) TSHRALDH1A1FFAR4FFAR1KDM4C
SCHEMBL4384337 0.95 TSHR (0.37) TSHRALDH1A1GSTK1ADRA1ABHMT
SCHEMBL4395402 0.89 FFAR4 (0.36) TSHRALDH1A1FFAR4FFAR1KDM4C
SCHEMBL4387909 0.87 FFAR4 (0.39) TSHRALDH1A1FFAR4FFAR1KDM4C
SCHEMBL4388748 0.87 FFAR4 (0.39) TSHRALDH1A1FFAR4FFAR1KDM4C
SCHEMBL4388297 0.87 FFAR4 (0.39) TSHRALDH1A1FFAR4FFAR1KDM4C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7629383-B2 Double esters DRUG DISCOVERY LABORATORY AS (NO) 2009-12-08 US disclosed
US-20050203181-A1 Double esters DRUG DISCOVERY LABORATORY AS (NO) 2005-09-15 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-20050203181-A1 Double esters ACACA, CES1, ACACB TSHR 1933/4885ALDH1A1 296/4885FFAR4 80/4885

“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.