SCHEMBL3327698

SCHEMBL3327698

CCCCCCCC(=O)OC(=O)OCC

nearest known ligand 0.59

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
DGKA P23743 1/20 0.59
SOAT1 P35610 1/20 0.54
PAM P19021 2/20 0.53
LMNA P02545 4/20 0.50
MAPT P10636 2/20 0.50
TSHR P16473 1/20 0.50
DNM1 Q05193 1/20 0.49
ALDH1A1 P00352 1/20 0.49
NAAA Q02083 1/20 0.48
KDM4E B2RXH2 1/20 0.47
DUSP3 P51452 1/20 0.47
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
MAPK1 P28482 1/20 0.47
CES2 O00748 2/20 0.46
CES1 P23141 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
SCHEMBL6890027 1.00 DGKA (0.59) DGKASOAT1PAMLMNAMAPT
SCHEMBL382296 1.00 DGKA (0.59) DGKASOAT1PAMLMNAMAPT
SCHEMBL27396784 1.00 DGKA (0.59) DGKASOAT1PAMLMNAMAPT
Hydrochloric Acid SCHEMBL27619222 0.96 SOAT1 (0.54) DGKASOAT1PAMLMNAMAPT
SCHEMBL6643452 0.94 SOAT1 (0.61) DGKASOAT1PAMLMNAMAPT
SCHEMBL20503311 0.92 SOAT1 (0.58) DGKASOAT1PAMLMNAMAPT
SCHEMBL381506 0.92 SOAT1 (0.64) DGKASOAT1PAMLMNAMAPT
SCHEMBL28005099 0.90 SOAT1 (0.56) DGKASOAT1PAMMAPTTSHR
SCHEMBL464534 0.90 FAAH (0.62) DGKASOAT1LMNAMAPTTSHR
SCHEMBL8968847 0.90 FAAH (0.62) DGKASOAT1LMNAMAPTTSHR

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
CN-109640965-A Compositions and methods for treating irritable bowel syndrome 塞尔利克斯生物私人有限公司 2019-04-16 CN disclosed
US-20100129436-A1 SUBTANCES FOR THE PROTECTION OF CELLS AND/OR TISSUES LOSEL RALF 2010-05-27 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-20100129436-A1 SUBTANCES FOR THE PROTECTION OF CELLS AND/OR TISSUES CTSA, BCL2, BAX DGKA 2070/4885SOAT1 4091/4885PAM 4857/4885

“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.