SCHEMBL1614901

SCHEMBL1614901

CCCC(CC)CN1C(=O)S/C(=C\c2cc(O)c(O)c(C(F)(F)F)c2)C1=O

nearest known ligand 0.69

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ SLC2A1 P11166 2/20 0.69
▸ COMT P21964 1/20 0.47
▸ KDM4E B2RXH2 1/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ THRB P10828 1/20 0.41
▸ HPGD P15428 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ BAG3 O95817 1/20 0.40
▸ PPARG P37231 1/20 0.40
▸ AKR1B1 P15121 1/20 0.39
▸ S1PR1 P21453 1/20 0.37
▸ CISD1 Q9NZ45 2/20 0.37
▸ CFTR P13569 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
SCHEMBL1614974 0.94 SLC2A1 (0.77) SLC2A1COMTALDH1A1KMT2ABAG3
SCHEMBL1613493 0.88 SLC2A1 (0.89) SLC2A1KDM4EALDH1A1THRBHPGD
SCHEMBL12737009 0.86 SLC2A1 (0.61) SLC2A1COMTALDH1A1BAG3PPARG
SCHEMBL1615131 0.86 SLC2A1 (0.61) SLC2A1COMTBAG3PPARGAKR1B1
SCHEMBL1614379 0.82 SLC2A1 (1.00) SLC2A1COMTALDH1A1KMT2ABAG3
SCHEMBL12712445 0.79 SLC2A1 (0.61) SLC2A1COMTKDM4EALDH1A1THRB
SCHEMBL1614903 0.78 SLC2A1 (0.51) SLC2A1COMTKDM4EALDH1A1THRB
SCHEMBL1614304 0.76 SLC2A1 (0.52) SLC2A1COMTKDM4EALDH1A1KMT2A
SCHEMBL1614533 0.76 NLRP3 (0.55) SLC2A1KMT2APPARG
SCHEMBL1614850 0.75 PRKAG1 (0.54) SLC2A1COMTBAG3PPARGAKR1B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2488027-A1 THIAZOLIDINEDIONE ENERGY RESTRICTION-MIMETIC AGENTS The Ohio State University Research Foundation (US) 2012-08-22 — — EP claimed
WO-2011044548-A1 THIAZOLIDINEDIONE ENERGY RESTRICTION-MIMETIC AGENTS THE OHIO STATE UNIVERSITY RESEARCH FOUNDATION (US) 2011-04-14 — — WO claimed
US-20110086895-A1 THIAZOLIDINEDIONE ENERGY RESTRICTION-MIMETIC AGENTS THE OHIO STATE UNIVERSITY RESEARCH FOUNDATION (US) 2011-04-14 — — US claimed
US-8383656-B2 Thiazolidinedione energy restriction-mimetic agents THE OHIO STATE UNIVERSITY RESEARCH FOUNDATION (US) 2013-02-26 — — US disclosed
US-20110086895-A1 THIAZOLIDINEDIONE ENERGY RESTRICTION-MIMETIC AGENTS THE OHIO STATE UNIVERSITY RESEARCH FOUNDATION (US) 2011-04-14 — — 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 (1 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-20110086895-A1 THIAZOLIDINEDIONE ENERGY RESTRICTION-MIMETIC AGENTS PCK2, AK2, SIRT6 SLC2A1 76/4885COMT 4225/4885KDM4E 1261/4885

“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.

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