SCHEMBL936657

SCHEMBL936657

O=Cc1ccc(OCC(O)c2cccc(F)c2)cc1

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAOA P21397 2/20 0.43
MAOB P27338 2/20 0.43
RAB9A P51151 1/20 0.39
PPARG P37231 2/20 0.39
GSK3B P49841 1/20 0.39
BACE1 P56817 1/20 0.39
CES2 O00748 1/20 0.38
CES1 P23141 1/20 0.38
KMT2A Q03164 1/20 0.38
NR4A2 P43354 1/20 0.37
CYP26A1 O43174 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP26B1 Q9NR63 1/20 0.37
LMNA P02545 1/20 0.37
ALDH1A1 P00352 1/20 0.37
L3MBTL1 Q9Y468 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
SCHEMBL937208 0.84 ADRB3 (0.48) CYP3A4
SCHEMBL936767 0.83 KMT2A (0.48) MAOAMAOBKMT2ALMNAALDH1A1
SCHEMBL937188 0.83 KMT2A (0.49) RAB9AKMT2ACYP3A4LMNAALDH1A1
SCHEMBL936476 0.83 KMT2A (0.49) RAB9AKMT2ACYP3A4LMNAALDH1A1
SCHEMBL936475 0.83 KMT2A (0.49) RAB9AKMT2ACYP3A4LMNAALDH1A1
SCHEMBL936670 0.83 PPARG (0.55) RAB9APPARGALDH1A1L3MBTL1
SCHEMBL936085 0.79 PIM1 (0.58) MAOAMAOB
SCHEMBL936084 0.79 PIM1 (0.58) MAOAMAOB
SCHEMBL27897342 0.76 PPARG (0.33) PPARGGSK3BBACE1CYP26A1CYP3A4
SCHEMBL936428 0.75 ALDH1A1 (0.41) RAB9AKMT2ACYP3A4LMNAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3202401-B1 PPAR-SPARING THIAZOLIDINEDIONES AND COMBINATIONS FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES CIRIUS THERAPEUTICS INC (US) 2019-10-23 EP disclosed
EP-2513070-B1 PPAR-SPARING THIAZOLIDINEDIONE SALTS FOR THE TREATMENT OF METABOLIC DISEASES CIRIUS THERAPEUTICS INC (US) 2017-11-08 EP disclosed
EP-2512470-B1 PPAR-SPARING THIAZOLIDINEDIONES AND COMBINATIONS FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES OCTETA THERAPEUTICS LLC (US) 2016-11-30 EP disclosed
US-20160051529-A1 PPAR-SPARING THIAZOLIDINEDIONES AND COMBINATIONS FOR THE TREATMENT OF NEURODEGENERATIVE AND OTHER METABOLIC DISEASES CIRIUS THERAPEUTICS, INC. 2016-02-25 US disclosed
EP-2931274-A1 PPAR-SPARING THIAZOLIDINEDIONES AND COMBINATIONS FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES Metabolic Solutions Development Company LLC (US) 2015-10-21 EP disclosed
US-9126959-B2 PPAR-sparing thiazolidinedione salts for the treatment of metabolic diseases METABOLIC SOLUTIONS DEVELOPMENT COMPANY, LLC (US) 2015-09-08 US disclosed
US-20150051406-A1 PPAR-SPARING THIAZOLIDINEDIONE SALTS FOR THE TREATMENT OF METABOLIC DISEASES CIRIUS THERAPEUTICS, INC. 2015-02-19 US disclosed
US-8912335-B2 PPAR-sparing thiazolidinedione salts for the treatment of metabolic diseases METABOLIC SOLUTIONS DEVELOPMENT COMPANY, LLC (US) 2014-12-16 US disclosed
WO-2014093114-A1 PPAR-SPARING THIAZOLIDINEDIONES AND COMBINATIONS FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES METABOLIC SOLUTIONS DEVELOPMENT COMPANY LLC (US) 2014-06-19 WO disclosed
US-20130281414-A1 THIAZOLIDINEDIONE ANALOGUES METABOLIC SOLUTIONS DEVELOPMENT COMPANY, LLC (US) 2013-10-24 US disclosed
WO-2011133611-A1 THIAZOLIDINEDIONE ANALOGUES METABOLIC SOLUTIONS DEVELOPMENT COMPANY (US) 2011-10-27 WO disclosed
WO-2011084453-A1 PPAR-SPARING THIAZOLIDINEDIONE SALTS FOR THE TREATMENT OF METABOLIC DISEASES METABOLIC SOLUTIONS DEVELOPMENT COMPANY (US) 2011-07-14 WO disclosed
WO-2011084459-A1 PPAR-SPARING THIAZOLIDINEDIONES AND COMBINATIONS FOR THE TREATMENT OF OBESITY AND OTHER METABOLIC DISEASES METABOLIC SOLUTIONS DEVELOPMENT COMPANY (US) 2011-07-14 WO disclosed
WO-2011084456-A1 PPAR-SPARING THIAZOLIDINEDIONES AND COMBINATIONS FOR THE TREATMENT OF DIABETES MELLITUS AND OTHER METABOLIC DISEASES METABOLIC SOLUTIONS DEVELOPMENT COMPANY (US) 2011-07-14 WO disclosed
WO-2011075514-A1 PPAR-SPARING THIAZOLIDINEDIONES AND COMBINATIONS FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES METABOLIC SOLUTIONS DEVELOPMENT COMPANY (US) 2011-06-23 WO disclosed
WO-2010105048-A9 THIAZOLIDINEDIONE ANALOGUES METABOLIC SOLUTIONS DEVELOPMENT COMPANY (US) 2011-01-27 WO disclosed
WO-2010105048-A1 THIAZOLIDINEDIONE ANALOGUES METABOLIC SOLUTIONS DEVELOPMENT COMPANY (US) 2010-09-16 WO disclosed
US-20100222399-A1 Thiazolidinedione Analogues For The Treatment Of Hypertension CIRIUS THERAPEUTICS, INC. 2010-09-02 US disclosed
EP-2203433-A1 THIAZOLIDINEDIONE ANALOGUES FOR THE TREATMENT OF HYPERTENSION Metabolic Solutions Development Company (US) 2010-07-07 EP disclosed
WO-2009038681-A1 THIAZOLIDINEDIONE ANALOGUES FOR THE TREATMENT OF HYPERTENSION METABOLIC SOLUTIONS DEVELOPMENT COMPANY (US) 2009-03-26 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 (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-20100222399-A1 Thiazolidinedione Analogues For The Treatment Of Hypertension AGTR2, ADRB1, ADRB3 MAOA 4460/4885MAOB 3837/4885RAB9A 4576/4885
US-20150051406-A1 PPAR-SPARING THIAZOLIDINEDIONE SALTS FOR THE TREATMENT OF METABOLIC DISEASES PPARD, PPARG, PPARA MAOA 3894/4885MAOB 3675/4885RAB9A 3629/4885
US-20160051529-A1 PPAR-SPARING THIAZOLIDINEDIONES AND COMBINATIONS FOR THE TREATMENT OF NEURODEGENERATIVE AND OTHER METABOLIC DISEASES PPARD, PPARG, PPARA MAOA 3779/4885MAOB 3418/4885RAB9A 3447/4885
US-20130281414-A1 THIAZOLIDINEDIONE ANALOGUES FABP1, PPARD, FABP4 MAOA 3756/4885MAOB 3654/4885RAB9A 4277/4885

“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.