SCHEMBL936428

SCHEMBL936428

O=Cc1ccc(OCC(O)c2ccccc2F)cc1

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.41
KDM4E B2RXH2 3/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
MAPT P10636 2/20 0.41
RAB9A P51151 1/20 0.40
KMT2A Q03164 3/20 0.39
MEN1 O00255 1/20 0.39
TAAR1 Q96RJ0 1/20 0.39
CYP3A4 P08684 1/20 0.39
LMNA P02545 2/20 0.37
PKM P14618 1/20 0.37
TSHR P16473 1/20 0.37
HPGD P15428 1/20 0.37
DRD1 P21728 1/20 0.36
ALDH1A3 P47895 1/20 0.36

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
SCHEMBL27892014 0.83 ALDH1A1 (0.41) ALDH1A1KDM4ESMN1; SMN2MAPTRAB9A
SCHEMBL936466 0.82 ALDH1A1 (0.45) ALDH1A1KDM4ESMN1; SMN2MAPTRAB9A
SCHEMBL937188 0.79 KMT2A (0.49) ALDH1A1KDM4ESMN1; SMN2RAB9AKMT2A
SCHEMBL936475 0.79 KMT2A (0.49) ALDH1A1KDM4ESMN1; SMN2RAB9AKMT2A
SCHEMBL936476 0.79 KMT2A (0.49) ALDH1A1KDM4ESMN1; SMN2RAB9AKMT2A
SCHEMBL936471 0.78 PIM1 (0.57) HPGD
SCHEMBL936472 0.78 PIM1 (0.57) HPGD
SCHEMBL936767 0.77 KMT2A (0.48) ALDH1A1SMN1; SMN2MAPTKMT2AMEN1
SCHEMBL936657 0.75 MAOA (0.43) ALDH1A1RAB9AKMT2ACYP3A4LMNA
SCHEMBL10694902 0.74 ALDH1A1 (0.62) ALDH1A1KDM4ESMN1; SMN2MAPTRAB9A

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 35 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-3202401-A1 PPAR-SPARING THIAZOLIDINEDIONES AND COMBINATIONS FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES Octeta Therapeutics, LLC (US) 2017-08-09 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
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 (3 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 ALDH1A1 500/4885KDM4E 2910/4885SMN1; SMN2 4871/4885
US-20150051406-A1 PPAR-SPARING THIAZOLIDINEDIONE SALTS FOR THE TREATMENT OF METABOLIC DISEASES PPARD, PPARG, PPARA ALDH1A1 783/4885KDM4E 3252/4885SMN1; SMN2 1843/4885
US-20160051529-A1 PPAR-SPARING THIAZOLIDINEDIONES AND COMBINATIONS FOR THE TREATMENT OF NEURODEGENERATIVE AND OTHER METABOLIC DISEASES PPARD, PPARG, PPARA ALDH1A1 1510/4885KDM4E 2439/4885SMN1; SMN2 379/4885

“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.