SCHEMBL24926280

SCHEMBL24926280

CC(C)(C)[C@@H]1CCCN1CCO

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.37
SLC6A9 P48067 1/20 0.34
AGL P35573 1/20 0.33
GAA P10253 2/20 0.32
GBA1 P04062 2/20 0.32
TDP1 Q9NUW8 1/20 0.32
MGAM O43451 1/20 0.32
LCT P09848 1/20 0.32
SI P14410 1/20 0.32
SPHK2 Q9NRA0 2/20 0.32
SPHK1 Q9NYA1 2/20 0.32
HRH3 Q9Y5N1 2/20 0.32
PDCD1LG2 Q9BQ51 1/20 0.31
CD274 Q9NZQ7 1/20 0.31
POLB P06746 1/20 0.31
L3MBTL1 Q9Y468 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
SCHEMBL24782349 0.83 SLC6A9 (0.35) SLC6A9TDP1SPHK2SPHK1POLB
SCHEMBL24926332 0.82 GBA1 (0.38) GBA1TDP1
SCHEMBL18199654 0.82 GBA1 (0.38) GBA1TDP1
SCHEMBL15471354 0.82 GBA1 (0.38) GBA1TDP1
SCHEMBL24926315 0.80 SLC6A9 (0.34) SLC6A9
SCHEMBL22541496 0.80 SLC6A9 (0.34) SLC6A9
SCHEMBL24926283 0.78 GBA2 (0.41) AGLGAAGBA1MGAMSI
SCHEMBL13297123 0.78 HTT (0.34) HTTAGLGBA1SPHK2SPHK1
SCHEMBL24926618 0.77 S1PR1 (0.44) GAAGBA1SPHK2SPHK1
SCHEMBL24926322 0.77 HSD11B1 (0.40) SLC6A9

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-20230031954-A1 TETRACYCLINE COMPOUNDS AND METHODS OF TREATMENT TETRAPHASE PHARMACEUTICALS, INC. 2023-02-02 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-20230031954-A1 TETRACYCLINE COMPOUNDS AND METHODS OF TREATMENT MCL1, ABL1, MALT1 HTT 2021/4885SLC6A9 622/4885AGL 3699/4885

“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.