SCHEMBL7044480

SCHEMBL7044480

CC(=O)N1c2ccc(OCS)cc2C(C)=CC1(C)C

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.60
MAPT P10636 8/20 0.60
KDM4E B2RXH2 7/20 0.60
ALOX12 P18054 5/20 0.60
GAA P10253 4/20 0.60
HTT P42858 4/20 0.60
TSHR P16473 3/20 0.60
HSD17B10 Q99714 2/20 0.60
CASP1 P29466 1/20 0.60
MEN1 O00255 4/20 0.57
KMT2A Q03164 4/20 0.57
L3MBTL1 Q9Y468 3/20 0.57
POLB P06746 1/20 0.57
LMNA P02545 2/20 0.56
HPGD P15428 4/20 0.55
TDP1 Q9NUW8 2/20 0.55
THRB P10828 2/20 0.55
MAPK1 P28482 1/20 0.50
PAX8 Q06710 1/20 0.46
NPSR1 Q6W5P4 3/20 0.45

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
SCHEMBL25204645 0.89 ALDH1A1 (0.74) ALDH1A1MAPTKDM4EALOX12GAA
SCHEMBL1323562 0.84 MAPT (0.70) ALDH1A1MAPTKDM4EALOX12GAA
SCHEMBL14406408 0.83 KMT2A (0.64) ALDH1A1MAPTKDM4EALOX12GAA
SCHEMBL6567228 0.81 ALDH1A1 (0.65) ALDH1A1MAPTKDM4EALOX12GAA
SCHEMBL7044479 0.80 LMNA (0.56) ALDH1A1MAPTKDM4EALOX12GAA
SCHEMBL7038965 0.79 LMNA (0.64) ALDH1A1MAPTKDM4EALOX12GAA
SCHEMBL11332800 0.78 ALDH1A1 (0.73) ALDH1A1MAPTKDM4EALOX12GAA
SCHEMBL8849533 0.77 LMNA (0.66) ALDH1A1MAPTKDM4EALOX12GAA
SCHEMBL8849935 0.77 KDM4E (0.53) ALDH1A1MAPTKDM4EALOX12GAA
SCHEMBL11341636 0.77 ALDH1A1 (0.75) ALDH1A1MAPTKDM4EALOX12GAA

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 7 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-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

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 ALDH1A1 945/4885MAPT 284/4885KDM4E 4364/4885
US-20030176448-A1 Mitochondria protecting agents for treating mitochondria associated diseases TFAM, HSPA9, HSPD1 ALDH1A1 936/4885MAPT 283/4885KDM4E 4356/4885
US-20020068750-A1 Mitochondria protecting agents for treating mitochondria associated diseases TFAM, HSPA9, HSPD1 ALDH1A1 931/4885MAPT 285/4885KDM4E 4384/4885
US-20020010195-A1 Mitochondria protecting agents for treating mitochondria associated diseases TFAM, HSPA9, HSPD1 ALDH1A1 945/4885MAPT 284/4885KDM4E 4364/4885
US-20020065299-A1 Mitochondria protecting agents for treating mitochondria associated diseases TFAM, HSPA9, HSPD1 ALDH1A1 942/4885MAPT 284/4885KDM4E 4366/4885

“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.