SCHEMBL7630274

SCHEMBL7630274

CC(=O)OC1CC(C)(C)N(O)C1(C)C

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
KMT2A Q03164 3/20 0.38
TSHR P16473 2/20 0.38
ALDH1A1 P00352 1/20 0.36
ESR1 P03372 1/20 0.36
HSD17B10 Q99714 1/20 0.36
CYP3A4 P08684 1/20 0.36
HTT P42858 1/20 0.34
CHRM2 P08172 5/20 0.32
CHRM1 P11229 3/20 0.32
CHRM4 P08173 2/20 0.32
CHRM5 P08912 2/20 0.32
CHRM3 P20309 2/20 0.32
SMN1; SMN2 Q16637 1/20 0.31
MEN1 O00255 2/20 0.31
CYP2D6 P10635 1/20 0.31
ACHE P22303 1/20 0.30

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
SCHEMBL8576187 0.83 GAA (0.44) GAAL3MBTL1ALDH1A1ESR1HSD17B10
SCHEMBL17931125 0.81 GAA (0.42) GAAL3MBTL1ALDH1A1HTTSMN1; SMN2
SCHEMBL17931117 0.81 GAA (0.42) GAAL3MBTL1HTT
SCHEMBL7630267 0.81 KMT2A (0.38) GAAKMT2ATSHRALDH1A1ESR1
SCHEMBL12786295 0.80 GAA (0.41) GAAL3MBTL1HTTCYP2D6
SCHEMBL26083151 0.79 GAA (0.40) GAAL3MBTL1HTT
SCHEMBL26083168 0.79 GAA (0.40) GAAL3MBTL1HTTCYP2D6
SCHEMBL26083169 0.79 GAA (0.40) GAAL3MBTL1HTT
SCHEMBL17931142 0.78 GAA (0.39) GAAL3MBTL1KMT2ASMN1; SMN2MEN1
SCHEMBL17931321 0.78 TSHR (0.40) GAAL3MBTL1KMT2ATSHRALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8466130-B2 Mitochondria targeted cationic anti-oxidant compounds for prevention, therapy or treatment of hyper-proliferative disease, neoplasias and cancers COLBY PHARMACEUTICAL COMPANY (US) 2013-06-18 US disclosed
US-20110059922-A1 MITOCHONDRIA TARGETED CATIONIC ANTI-OXIDANT COMPOUNDS FOR PREVENTION, THERAPY OR TREATMENT OF HYPER-PROLIFERATIVE DISEASE, NEOPLASIAS AND CANCERS COLBY PHARMACEUTICAL COMPANY (US) 2011-03-10 US disclosed
EP-1186588-A1 6-HYDROXY-2-NAPHTHYLCARBINOL AND PROCESS FOR THE PREPARATION THEREOF MITSUBISHI CHEMICAL CORPORATION (JP) 2002-03-13 EP 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-20110059922-A1 MITOCHONDRIA TARGETED CATIONIC ANTI-OXIDANT COMPOUNDS FOR PREVENTION, THERAPY OR TREATMENT OF HYPER-PROLIFERATIVE DISEASE, NEOPLASIAS AND CANCERS TFAM, HSPD1, NLN GAA 1476/4885L3MBTL1 1529/4885KMT2A 3446/4885

“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.