SCHEMBL26459796

SCHEMBL26459796

CCC(C)(CC(C)(C)C)c1ccc2c(c1)C(c1ccc(OCCOc3ccc(C4C(=O)Oc5ccc(C(C)(C)CC(C)(C)C)cc54)cc3)cc1)C(=O)O2

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 3/20 0.39
SMN1; SMN2 Q16637 3/20 0.39
GAA P10253 1/20 0.37
ALDH1A1 P00352 5/20 0.35
HPGD P15428 1/20 0.35
HIF1A Q16665 4/20 0.33
MEN1 O00255 2/20 0.33
APAF1 O14727 2/20 0.33
USP2 O75604 2/20 0.33
LMNA P02545 2/20 0.33
ERBB2 P04626 2/20 0.33
TP53 P04637 2/20 0.33
FYN P06241 2/20 0.33
CHRM2 P08172 2/20 0.33
CHRM4 P08173 2/20 0.33
CHRM5 P08912 2/20 0.33
ADRA2A P08913 2/20 0.33
MAPT P10636 2/20 0.33
HSPD1 P10809 2/20 0.33
CHRM1 P11229 2/20 0.33

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
SCHEMBL26459783 0.93 CYP3A4 (0.44) CYP3A4SMN1; SMN2GAAALDH1A1HPGD
SCHEMBL5205362 0.79 GAA (0.59) CYP3A4SMN1; SMN2GAAALDH1A1HPGD
SCHEMBL22068545 0.74 MAPT (0.40) CYP3A4SMN1; SMN2GAAALDH1A1HPGD
SCHEMBL17172384 0.73 GAA (0.41) CYP3A4GAAALDH1A1HPGDHIF1A
SCHEMBL23071652 0.73 GAA (0.34) CYP3A4SMN1; SMN2GAAALDH1A1HPGD
SCHEMBL18590074 0.73 GAA (0.34) CYP3A4SMN1; SMN2GAAALDH1A1HPGD
SCHEMBL22202050 0.72 GAA (0.34) CYP3A4SMN1; SMN2GAAALDH1A1HPGD
SCHEMBL22068557 0.72 GAA (0.34) CYP3A4SMN1; SMN2GAAALDH1A1HPGD
SCHEMBL466198 0.72 GAA (0.34) CYP3A4SMN1; SMN2GAAALDH1A1HPGD
SCHEMBL14556835 0.72 CYP3A4 (0.41) CYP3A4SMN1; SMN2GAAALDH1A1HPGD

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-20230127329-A1 LACTONE COMPOUND FUJIFILM CORPORATION (JP) 2023-04-27 US disclosed
US-20230127329-A1 LACTONE COMPOUND FUJIFILM CORPORATION (JP) 2023-04-27 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-20230127329-A1 LACTONE COMPOUND LANCL1, GPX1, LOXL1 CYP3A4 171/4885SMN1; SMN2 4311/4885GAA 503/4885

“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.