SCHEMBL12712431

SCHEMBL12712431

Cc1cc(/C=C2\SC(=O)N(Cc3ccc(C(C)(C)C)cc3)C2=O)ccc1O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ENPP2 Q13822 4/20 0.57
▸ PTPN1 P18031 4/20 0.56
▸ ACP1 P24666 4/20 0.56
▸ BAG3 O95817 1/20 0.50
▸ PPARG P37231 1/20 0.49
▸ MEN1 O00255 2/20 0.48
▸ POLB P06746 2/20 0.48
▸ KMT2A Q03164 2/20 0.48
▸ ALDH1A1 P00352 1/20 0.48
▸ MAPT P10636 1/20 0.48
▸ CRHBP P24387 1/20 0.48
▸ MAPK1 P28482 1/20 0.48
▸ CRHR2 Q13324 1/20 0.48
▸ NOD2 Q9HC29 1/20 0.48
▸ TDP1 Q9NUW8 1/20 0.48
▸ L3MBTL1 Q9Y468 1/20 0.48
▸ SLC2A1 P11166 2/20 0.48
▸ PIM1 P11309 1/20 0.48
▸ HSP90AA1 P07900 1/20 0.48
▸ GAA P10253 1/20 0.48

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
SCHEMBL12712450 0.88 ENPP2 (0.52) ENPP2PTPN1ACP1BAG3PPARG
SCHEMBL12712437 0.87 ENPP2 (0.64) ENPP2PTPN1ACP1PPARGMEN1
SCHEMBL1615013 0.87 SLC2A1 (0.66) ENPP2PTPN1ACP1BAG3PPARG
SCHEMBL12712430 0.85 PTPN1 (0.56) ENPP2PTPN1ACP1BAG3PPARG
SCHEMBL1614334 0.80 ENPP2 (0.54) ENPP2PTPN1ACP1PPARGMEN1
SCHEMBL1614940 0.80 SLC2A1 (0.52) ENPP2PTPN1ACP1PPARGMEN1
SCHEMBL8172925 0.78 AKR1B1 (0.69) BAG3MCL1
SCHEMBL12712441 0.78 SLC2A1 (0.57) PTPN1ACP1BAG3MEN1POLB
SCHEMBL8172926 0.78 AKR1B1 (0.69) BAG3MCL1
SCHEMBL16489850 0.77 SLC2A1 (0.79) PTPN1ACP1BAG3PPARGMEN1

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 2 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
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 ENPP2 1288/4885PTPN1 863/4885ACP1 1572/4885

“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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