SCHEMBL7043294

SCHEMBL7043294

CC(C)(CC(c1ccccc1)c1ccccc1)O[C]=O

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH1 P35367 4/20 0.37
CACNA1F O60840 1/20 0.37
CHRM2 P08172 1/20 0.37
CHRM1 P11229 1/20 0.37
ADRA2B P18089 1/20 0.37
CHRM3 P20309 1/20 0.37
ADRA1A P35348 1/20 0.37
OPRK1 P41145 1/20 0.37
CACNA1D Q01668 1/20 0.37
SLC6A3 Q01959 1/20 0.37
KCNH2 Q12809 1/20 0.37
CACNA1S Q13698 1/20 0.37
CACNA1C Q13936 1/20 0.37
SCN5A Q14524 1/20 0.37
KDM4E B2RXH2 1/20 0.37
LMNA P02545 1/20 0.37
MEN1 O00255 1/20 0.36
GAA P10253 1/20 0.36
KMT2A Q03164 1/20 0.36
HTR2A P28223 4/20 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
SCHEMBL707821 0.75 HRH1 (0.40) HRH1CACNA1FCHRM2CHRM1ADRA2B
SCHEMBL95876 0.73 SLC6A2 (0.47) LMNATAAR1
SCHEMBL5079703 0.71 HRH1 (0.52) HRH1CACNA1FCHRM2CHRM1ADRA2B
SCHEMBL5252028 0.70 KCNA3 (0.39) LMNATAAR1
SCHEMBL4980093 0.70 ALDH1A1 (0.37) MEN1KMT2ATAAR1TDP1ATM
SCHEMBL11339531 0.70 MAPK1 (0.38) KCNH2KMT2ATAAR1
SCHEMBL131978 0.70 MAPK1 (0.44) MEN1KMT2ATAAR1TSHR
SCHEMBL6779249 0.69
SCHEMBL97085 0.68 TSHR (0.47) KDM4EL3MBTL1TSHR
SCHEMBL5046280 0.67 TAAR1 (0.48) HRH1CACNA1FCHRM2CHRM1ADRA2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030176448-A1 Mitochondria protecting agents for treating mitochondria associated diseases MITOKOR (US) 2003-09-18 US disclosed
US-6511966-B2 Administering for therapy of mitochondria medited disease MITOKOR 2003-01-28 US disclosed
US-6498191-B2 FOR TREATMENT OF ALZHEIMER'S DISEASE, DIABETES MELLITUS, PARKINSON'S DISEASE, NEURONAL AND CARDIAC ISCHEMIA, HUNTINGTON'S DISEASE, STROKE MITOKOR 2002-12-24 US disclosed
EP-1222920-A2 Mitochondria protecting agents for treating mitochondria associated diseases MITOKOR (US) 2002-07-17 EP disclosed
US-20020068750-A1 Mitochondria protecting agents for treating mitochondria associated diseases GHOSH SOUMITRA S (US) 2002-06-06 US disclosed
US-20020065298-A1 Mitochondria protecting agents for treating mitochondria associated diseases GHOSH SOUMITRA S (US) 2002-05-30 US disclosed
US-20020065299-A1 Mitochondria protecting agents for treating mitochondria associated diseases GHOSH SOUMITRA S (US) 2002-05-30 US disclosed
US-20020010195-A1 Mitochondria protecting agents for treating mitochondria associated diseases GHOSH SOUMITRA S (US) 2002-01-24 US disclosed
EP-1051165-A2 MITOCHONDRIA PROTECTING AGENTS FOR TREATING MITOCHONDRIA ASSOCIATED DISEASES Mitokor (US) 2000-11-15 EP disclosed
WO-1999037294-A2 MITOCHONDRIA PROTECTING AGENTS FOR TREATING MITOCHONDRIA ASSOCIATED DISEASES MITOKOR (US) 1999-07-29 WO 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 (5 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-20020065298-A1 Mitochondria protecting agents for treating mitochondria associated diseases TFAM, HSPA9, HSPD1 HRH1 3806/4885CACNA1F 2335/4885CHRM2 3133/4885
US-20030176448-A1 Mitochondria protecting agents for treating mitochondria associated diseases TFAM, HSPA9, HSPD1 HRH1 3825/4885CACNA1F 2364/4885CHRM2 3165/4885
US-20020068750-A1 Mitochondria protecting agents for treating mitochondria associated diseases TFAM, HSPA9, HSPD1 HRH1 3769/4885CACNA1F 2339/4885CHRM2 3091/4885
US-20020010195-A1 Mitochondria protecting agents for treating mitochondria associated diseases TFAM, HSPA9, HSPD1 HRH1 3806/4885CACNA1F 2335/4885CHRM2 3133/4885
US-20020065299-A1 Mitochondria protecting agents for treating mitochondria associated diseases TFAM, HSPA9, HSPD1 HRH1 3720/4885CACNA1F 2333/4885CHRM2 3149/4885

“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.