SCHEMBL20072294

SCHEMBL20072294

CCCCCCCCCCCCC[C@H](O)C[C@H](O)COC(C)=O

nearest known ligand 0.68

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
USP2 O75604 3/20 0.68
ALDH1A1 P00352 2/20 0.68
CYP3A4 P08684 2/20 0.68
MAPT P10636 2/20 0.68
MEN1 O00255 2/20 0.68
KMT2A Q03164 2/20 0.68
HPGD P15428 1/20 0.68
SMN1; SMN2 Q16637 1/20 0.68
TP53 P04637 1/20 0.68
MAPK1 P28482 1/20 0.68
GPR84 Q9NQS5 6/20 0.49
FFAR4 Q5NUL3 1/20 0.47
FFAR1 O14842 1/20 0.47
KDM4E B2RXH2 1/20 0.46
DUSP3 P51452 1/20 0.46
LMNA P02545 1/20 0.46
ENPP2 Q13822 3/20 0.44
TRPV1 Q8NER1 1/20 0.44

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
SCHEMBL13054629 1.00 USP2 (0.68) USP2ALDH1A1CYP3A4MAPTMEN1
SCHEMBL1965555 1.00 USP2 (0.68) USP2ALDH1A1CYP3A4MAPTMEN1
SCHEMBL27881284 1.00 USP2 (0.68) USP2ALDH1A1CYP3A4MAPTMEN1
SCHEMBL9329637 0.91 ALDH1A1 (0.55) USP2ALDH1A1CYP3A4MAPTMEN1
SCHEMBL10849155 0.91 ALDH1A1 (0.55) USP2ALDH1A1CYP3A4MAPTMEN1
SCHEMBL28454145 0.91 ALDH1A1 (0.55) USP2ALDH1A1CYP3A4MAPTMEN1
SCHEMBL10007317 0.91 ALDH1A1 (0.55) USP2ALDH1A1CYP3A4MAPTMEN1
SCHEMBL10847415 0.91 ALDH1A1 (0.55) USP2ALDH1A1CYP3A4MAPTMEN1
SCHEMBL11506586 0.91 ALDH1A1 (0.55) USP2ALDH1A1CYP3A4MAPTMEN1
SCHEMBL4948952 0.91 USP2 (0.70) USP2ALDH1A1CYP3A4MAPTMEN1

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-10932484-B2 Inhibitory activity of acetogenins against Listeria monocytogenes INSTITUTO TECNOLOGICO Y DE ESTUDIOS SUPERIORES DE MONTERREY (MX) 2021-03-02 US disclosed
US-20180103671-A1 INHIBITORY ACTIVITY OF ACETOGENINS AGAINST LISTERIA MONOCYTOGENES INSTITUTO TECNOLOGICO Y DE ESTUDIOS SUPERIORES DE MONTERREY (MX) 2018-04-19 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-20180103671-A1 INHIBITORY ACTIVITY OF ACETOGENINS AGAINST LISTERIA MONOCYTOGENES LTN1, LCT, LSS USP2 1358/4885ALDH1A1 505/4885CYP3A4 4070/4885
US-10932484-B2 Inhibitory activity of acetogenins against Listeria monocytogenes LTN1, LCT, LSS USP2 1358/4885ALDH1A1 505/4885CYP3A4 4070/4885

“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.