SCHEMBL5772491

SCHEMBL5772491

CC1(CCC(=O)O)CCc2ccc(O)c(O)c2O1

nearest known ligand 0.64

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
AKT1 P31749 7/20 0.64
ALOX5 P09917 9/20 0.44
PDPK1 O15530 1/20 0.39
PHLPP1 O60346 1/20 0.39
ILK Q13418 1/20 0.39
NR1I2 O75469 2/20 0.39
PPARG P37231 1/20 0.39
PPARA Q07869 1/20 0.39
NPC1 O15118 1/20 0.37
PTGES O14684 1/20 0.37

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
SCHEMBL10706473 0.85 AKT1 (0.47) AKT1ALOX5PDPK1PHLPP1ILK
SCHEMBL4779936 0.82 ALOX5 (0.47) AKT1ALOX5PDPK1PHLPP1ILK
SCHEMBL407517 0.78 AKT1 (0.65) AKT1ALOX5PDPK1PHLPP1ILK
SCHEMBL29393858 0.78 AKT1 (0.65) AKT1ALOX5PDPK1PHLPP1ILK
SCHEMBL5441388 0.78 AKT1 (0.65) AKT1ALOX5PDPK1PHLPP1ILK
SCHEMBL3270839 0.78 AKT1 (0.65) AKT1ALOX5PDPK1PHLPP1ILK
SCHEMBL5770011 0.78 ALOX5 (0.46) AKT1ALOX5PDPK1PHLPP1ILK
SCHEMBL30461429 0.75 ALOX5 (0.71) AKT1ALOX5NR1I2PPARGPPARA
SCHEMBL4639828 0.75 ALOX5 (0.71) AKT1ALOX5NR1I2PPARGPPARA
SCHEMBL969505 0.74 ALOX5 (0.45) AKT1ALOX5PDPK1PHLPP1ILK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2004045534-A2 CHROMAN DERIVATIVES FOR THE REDUCTION OF INFLAMMATION SYMPTOMS GALILEO PHARMACEUTICALS, INC. (US) 2004-06-03 WO claimed
US-20040097433-A1 Chroman derivatives for the reduction of inflammation symptoms MONSANTO TECHNOLOGY LLC 2004-05-20 US claimed
US-20160324823-A1 TREATMENT OF MITOCHONDRIAL DISEASES BIOELECTRON TECHNOLOGY CORPORATION 2016-11-10 US disclosed
US-20130267538-A1 TREATMENT OF MITOCHONDRIAL DISEASES GALILEO PHARMACEUTICALS INC. 2013-10-10 US disclosed
WO-2005032544-A1 TREATMENT OF MITOCHONDRIAL DISEASES GALILEO PHARMACEUTICALS, INC. (US) 2005-04-14 WO disclosed
US-20050065099-A1 Alzheimer's disease; Parkinson's disease; brain disorders; antiepileptic agents; amyotrophic lateral sclerosis; vision defects EDISON PHARMACEUTICALS, INC. 2005-03-24 US disclosed
WO-2004045534-A2 CHROMAN DERIVATIVES FOR THE REDUCTION OF INFLAMMATION SYMPTOMS GALILEO PHARMACEUTICALS, INC. (US) 2004-06-03 WO disclosed
US-20040097433-A1 Chroman derivatives for the reduction of inflammation symptoms MONSANTO TECHNOLOGY LLC 2004-05-20 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 (4 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-20050065099-A1 Alzheimer's disease; Parkinson's disease; brain disorders; antiepileptic agents; amyotrophic lateral sclerosis; vision defects CLN6, LDHA, NLN AKT1 3301/4885ALOX5 1992/4885PDPK1 1893/4885
US-20160324823-A1 TREATMENT OF MITOCHONDRIAL DISEASES NLN, FH, MFN2 AKT1 3502/4885ALOX5 1604/4885PDPK1 2127/4885
US-20040097433-A1 Chroman derivatives for the reduction of inflammation symptoms CCL2, MPO, MB AKT1 4329/4885ALOX5 1449/4885PDPK1 2675/4885
US-20130267538-A1 TREATMENT OF MITOCHONDRIAL DISEASES NLN, FH, MFN2 AKT1 3502/4885ALOX5 1604/4885PDPK1 2127/4885

“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.