SCHEMBL2059460

SCHEMBL2059460

Cc1c(C)c2c(c(C)c1O)CCC(C)(C(=O)N(C)C)O2

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 1/20 0.72
PTGS2 P35354 1/20 0.72
CYP1A2 P05177 1/20 0.72
CYP3A4 P08684 1/20 0.72
TSHR P16473 1/20 0.72
BCHE P06276 2/20 0.45
ALOX5 P09917 3/20 0.44
NR1I2 O75469 2/20 0.44
CAPN1 P07384 1/20 0.43
MAPT P10636 2/20 0.43
LMNA P02545 2/20 0.43
TTPA P49638 2/20 0.43
MEN1 O00255 1/20 0.43
GSTP1 P09211 1/20 0.43
KMT2A Q03164 1/20 0.43
USP2 O75604 1/20 0.43
THRB P10828 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
ACHE P22303 1/20 0.42

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
SCHEMBL1927456 0.87 PTGS1 (0.65) PTGS1PTGS2CYP1A2CYP3A4TSHR
SCHEMBL2059486 0.87 PTGS1 (0.65) PTGS1PTGS2CYP1A2CYP3A4TSHR
SCHEMBL17289303 0.84 PTGS1 (0.58) PTGS1PTGS2CYP1A2CYP3A4TSHR
SCHEMBL1928208 0.84 PTGS1 (0.78) PTGS1PTGS2CYP1A2CYP3A4TSHR
Trolox SCHEMBL3226 0.84 PTGS1 (1.00) PTGS1PTGS2CYP1A2CYP3A4TSHR
(R)-Trolox SCHEMBL615168 0.84 PTGS1 (1.00) PTGS1PTGS2CYP1A2CYP3A4TSHR
SCHEMBL8270579 0.84 PTGS1 (0.78) PTGS1PTGS2CYP1A2CYP3A4TSHR
Trolox SCHEMBL1651402 0.84 PTGS1 (1.00) PTGS1PTGS2CYP1A2CYP3A4TSHR
Trolox SCHEMBL1927837 0.84 PTGS1 (1.00) PTGS1PTGS2CYP1A2CYP3A4TSHR
SCHEMBL16247633 0.84 PTGS1 (0.78) PTGS1PTGS2CYP1A2CYP3A4TSHR

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 21 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3733642-B1 4-(P-QUINONYL)-2-HYDROXYBUTANAMIDE DERIVATIVES FOR TREATMENT OF MITOCHONDRIAL DISEASES PTC THERAPEUTICS INC (US) 2024-05-08 EP disclosed
US-11840497-B2 4-(p-quinonyl)-2-hydroxybutanamide derivatives for treatment of mitochondrial diseases PTC THERAPEUTICS, INC. (US) 2023-12-12 US disclosed
US-20210179542-A1 4-(p-QUINONYL)-2-HYDROXYBUTANAMIDE DERIVATIVES FOR TREATMENT OF MITOCHONDRIAL DISEASES BIOELECTRON TECHNOLOGY CORPORATION 2021-06-17 US disclosed
US-10968166-B2 4-(P-quinonyl)-2-hydroxybutanamide derivatives for treatment of mitochondrial diseases PTC THERAPEUTICS, INC. (US) 2021-04-06 US disclosed
EP-3733642-A1 4-(P-QUINONYL)-2-HYDROXYBUTANAMIDE DERIVATIVES FOR TREATMENT OF MITOCHONDRIAL DISEASES PTC Therapeutics, Inc. (US) 2020-11-04 EP disclosed
EP-3456707-B1 4- (P-QUINONYL)-2-HYDROXYBUTANAMIDE DERIVATIVES FOR TREATMENT OF MITOCHONDRIAL DISEASES PTC THERAPEUTICS INC (US) 2020-04-15 EP disclosed
US-20190270699-A1 4-(P-QUINONYL)-2-HYDROXYBUTANAMIDE DERIVATIVES FOR TREATMENT OF MITOCHONDRIAL DISEASES PTC THERAPEUTICS, INC. 2019-09-05 US disclosed
EP-3456707-A1 4- (P-QUINONYL)-2-HYDROXYBUTANAMIDE DERIVATIVES FOR TREATMENT OF MITOCHONDRIAL DISEASES BioElectron Technology Corporation (US) 2019-03-20 EP disclosed
US-10167251-B2 4-(p-quinonyl)-2-hydroxybutanamide derivatives for treatment of mitochondrial diseases BIOELECTRON TECHNOLOGY CORPORATION (US) 2019-01-01 US disclosed
EP-3018122-B1 4-(P-QUINONYL)-2-HYDROXYBUTANAMIDE DERIVATIVES FOR TREATMENT OF MITOCHONDRIAL DISEASES BIOELECTRON TECH CORP (US) 2018-10-10 EP disclosed
US-9546132-B2 4-(p-quinonyl)-2-hydroxybutanamide derivatives for treatment of mitochondrial diseases EDISON PHARMACEUTICALS, INC. (US) 2017-01-17 US disclosed
EP-3018122-A1 4-(P-QUINONYL)-2-HYDROXYBUTANAMIDE DERIVATIVES FOR TREATMENT OF MITOCHONDRIAL DISEASES Edison Pharmaceuticals, Inc. (US) 2016-05-11 EP disclosed
US-20160075638-A1 4-(p-QUINONYL)-2-HYDROXYBUTANAMIDE DERIVATIVES FOR TREATMENT OF MITOCHONDRIAL DISEASES PTC THERAPEUTICS, INC. 2016-03-17 US disclosed
EP-2220030-B1 4- (P-QUINONYL)-2-HYDROXYBUTANAMIDE DERIVATIVES FOR TREATMENT OF MITOCHONDRIAL DISEASES EDISON PHARMACEUTICALS INC (US) 2016-01-13 EP disclosed
US-9169196-B2 4-(p-quinonyl)-2-hydroxybutanamide derivatives for treatment of mitochondrial diseases EDISON PHARMACEUTICALS, INC. (US) 2015-10-27 US disclosed
US-20130289034-A1 4-(p-QUINONYL)-2-HYDROXYBUTANAMIDE DERIVATIVES FOR TREATMENT OF MITOCHONDRIAL DISEASES PTC THERAPEUTICS, INC. 2013-10-31 US disclosed
US-8519001-B2 4-(p-quinonyl)-2-hydroxybutanamide derivatives for treatment of mitochondrial diseases EDISON PHARMACEUTICALS, INC. (US) 2013-08-27 US disclosed
US-20120122934-A1 4-(p-QUINONYL)-2-HYDROXYBUTANAMIDE DERIVATIVES FOR TREATMENT OF MITOCHONDRIAL DISEASES PTC THERAPEUTICS, INC. 2012-05-17 US disclosed
US-7968746-B2 4-(p-quinonyl)-2-hydroxybutanamide derivatives for treatment of mitochondrial diseases EDISON PHARMACEUTICALS, INC. (US) 2011-06-28 US disclosed
US-20090118257-A1 4-(p-QUINONYL)-2-HYDROXYBUTANAMIDE DERIVATIVES FOR TREATMENT OF MITOCHONDRIAL DISEASES PTC THERAPEUTICS, INC. 2009-05-07 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 (9 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-20190270699-A1 4-(P-QUINONYL)-2-HYDROXYBUTANAMIDE DERIVATIVES FOR TREATMENT OF MITOCHONDRIAL DISEASES FH, NLN, ACAA2 PTGS1 2791/4885PTGS2 2540/4885CYP1A2 3891/4885
US-20130289034-A1 4-(p-QUINONYL)-2-HYDROXYBUTANAMIDE DERIVATIVES FOR TREATMENT OF MITOCHONDRIAL DISEASES FH, NLN, ACAA2 PTGS1 2770/4885PTGS2 2594/4885CYP1A2 3899/4885
US-20160075638-A1 4-(p-QUINONYL)-2-HYDROXYBUTANAMIDE DERIVATIVES FOR TREATMENT OF MITOCHONDRIAL DISEASES FH, NLN, ACAA2 PTGS1 2770/4885PTGS2 2594/4885CYP1A2 3899/4885
US-11840497-B2 4-(p-quinonyl)-2-hydroxybutanamide derivatives for treatment of mitochondrial diseases FH, NLN, ACAA2 PTGS1 2770/4885PTGS2 2594/4885CYP1A2 3899/4885
US-20120122934-A1 4-(p-QUINONYL)-2-HYDROXYBUTANAMIDE DERIVATIVES FOR TREATMENT OF MITOCHONDRIAL DISEASES FH, NLN, ACAA2 PTGS1 2770/4885PTGS2 2594/4885CYP1A2 3899/4885
US-20210179542-A1 4-(p-QUINONYL)-2-HYDROXYBUTANAMIDE DERIVATIVES FOR TREATMENT OF MITOCHONDRIAL DISEASES FH, NLN, ACAA2 PTGS1 2770/4885PTGS2 2594/4885CYP1A2 3899/4885
US-20090118257-A1 4-(p-QUINONYL)-2-HYDROXYBUTANAMIDE DERIVATIVES FOR TREATMENT OF MITOCHONDRIAL DISEASES FH, NLN, ACAA2 PTGS1 2770/4885PTGS2 2594/4885CYP1A2 3899/4885
US-10167251-B2 4-(p-quinonyl)-2-hydroxybutanamide derivatives for treatment of mitochondrial diseases FH, NLN, ACAA2 PTGS1 2860/4885PTGS2 2651/4885CYP1A2 3880/4885
US-10968166-B2 4-(P-quinonyl)-2-hydroxybutanamide derivatives for treatment of mitochondrial diseases FH, NLN, ACAA2 PTGS1 2791/4885PTGS2 2540/4885CYP1A2 3891/4885

“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.