SCHEMBL12737009

SCHEMBL12737009

CCC(CC)CCCN1C(=O)S/C(=C\c2cc(O)c(O)c(C(F)(F)F)c2)C1=O

nearest known ligand 0.61

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ SLC2A1 P11166 2/20 0.61
▸ COMT P21964 1/20 0.47
▸ BAG3 O95817 1/20 0.40
▸ PPARG P37231 1/20 0.40
▸ CISD1 Q9NZ45 2/20 0.39
▸ AKR1B1 P15121 1/20 0.39
▸ MYC P01106 1/20 0.38
▸ MAPK1 P28482 2/20 0.38
▸ MAOA P21397 1/20 0.38
▸ MAOB P27338 1/20 0.38
▸ PTPN1 P18031 1/20 0.38
▸ MITF O75030 1/20 0.37
▸ ALDH1A1 P00352 1/20 0.37
▸ POLB P06746 1/20 0.37
▸ RAB9A P51151 1/20 0.37
▸ SMN1; SMN2 Q16637 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
SCHEMBL12736548 0.88 SLC2A1 (0.78) SLC2A1BAG3PPARGCISD1AKR1B1
SCHEMBL1614974 0.88 SLC2A1 (0.77) SLC2A1COMTBAG3PPARGAKR1B1
SCHEMBL1614901 0.86 SLC2A1 (0.69) SLC2A1COMTBAG3PPARGCISD1
SCHEMBL12712446 0.86 COMT (0.50) SLC2A1COMTBAG3PPARGCISD1
SCHEMBL1615131 0.81 SLC2A1 (0.61) SLC2A1COMTBAG3PPARGAKR1B1
SCHEMBL12406501 0.78 SLC2A1 (0.68) SLC2A1BAG3PPARGAKR1B1POLB
SCHEMBL2174438 0.78 SLC2A1 (0.68) SLC2A1BAG3PPARGAKR1B1POLB
SCHEMBL2174436 0.78 SLC2A1 (0.68) SLC2A1BAG3PPARGAKR1B1POLB
SCHEMBL12712459 0.78 CISD1 (0.46) SLC2A1COMTCISD1MYCMAPK1
SCHEMBL12712428 0.78 SLC2A1 (0.57) SLC2A1BAG3PPARGCISD1MYC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8383656-B2 Thiazolidinedione energy restriction-mimetic agents THE OHIO STATE UNIVERSITY RESEARCH FOUNDATION (US) 2013-02-26 — — US disclosed
WO-2011044548-A1 THIAZOLIDINEDIONE ENERGY RESTRICTION-MIMETIC AGENTS THE OHIO STATE UNIVERSITY RESEARCH FOUNDATION (US) 2011-04-14 — — WO 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 4225/4885BAG3 2468/4885

“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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