SCHEMBL26068684

SCHEMBL26068684

CC(C)COCCOC(C)(COc1cccc(C(=O)NCCOCCOCCOCCCNC(C)S)c1)SSC(C)(C)C

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 1/20 0.41
▸ MAPT P10636 1/20 0.41
▸ MAOB P27338 2/20 0.37
▸ ALDH1A1 P00352 3/20 0.37
▸ CHRM2 P08172 1/20 0.36
▸ DRD2 P14416 2/20 0.36
▸ DRD4 P21917 2/20 0.36
▸ DRD3 P35462 2/20 0.36
▸ NAMPT P43490 1/20 0.36
▸ F10 P00742 2/20 0.35
▸ KMT2A Q03164 4/20 0.35
▸ LMNA P02545 2/20 0.35
▸ MEN1 O00255 2/20 0.35
▸ L3MBTL1 Q9Y468 2/20 0.35
▸ TAAR1 Q96RJ0 1/20 0.35
▸ MCHR1 Q99705 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ KAT6A Q92794 1/20 0.35

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
SCHEMBL24972998 0.94 GAA (0.42) GAAMAPTMAOBALDH1A1CHRM2
SCHEMBL22327267 0.87 GAA (0.44) GAAMAPTMAOBALDH1A1CHRM2
SCHEMBL24970907 0.86 KAT6A (0.38) GAAMAPTMAOBALDH1A1CHRM2
SCHEMBL24849635 0.85 MAPT (0.41) GAAMAPTMAOBALDH1A1CHRM2
SCHEMBL24972999 0.84 KAT6A (0.40) GAAMAPTALDH1A1F10KMT2A
SCHEMBL22327273 0.84 GAA (0.41) GAAMAPTMAOBALDH1A1CHRM2
SCHEMBL24849637 0.83 ALDH1A1 (0.36) GAAMAPTMAOBALDH1A1CHRM2
SCHEMBL25753951 0.80 GAA (0.37) GAAMAPTMAOBALDH1A1CHRM2
SCHEMBL22327237 0.80 ALDH1A1 (0.37) GAAMAPTMAOBALDH1A1CHRM2
SCHEMBL26068748 0.80 MAPT (0.43) GAAMAPTMAOBALDH1A1CHRM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230257414-A1 NUCLEOTIDE ANALOGUES FIRST-CITIZENS BANK & TRUST COMPANY 2023-08-17 — — 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-20230257414-A1 NUCLEOTIDE ANALOGUES ITPA, POLB, NUDT1 GAA 1026/4885MAPT 4328/4885MAOB 1827/4885

“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.

Send feedback