SCHEMBL3568174

SCHEMBL3568174

Cc1cc(C)cc(S(=O)(=O)n2ccc3ccc(C(=O)Nc4ccc(C(=O)OC(C)(C)C)cc4)cc32)c1

nearest known ligand 0.75

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CPT1A P50416 12/20 0.75
CPT2 P23786 8/20 0.75
CPT1B Q92523 11/20 0.69
STAT3 P40763 2/20 0.52
PPARG P37231 4/20 0.45
PPARD Q03181 4/20 0.45
PPARA Q07869 4/20 0.45
HTR6 P50406 1/20 0.41
ENPP2 Q13822 1/20 0.40

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
SCHEMBL27715639 0.91 CPT1A (0.72) CPT1ACPT2CPT1BSTAT3PPARG
SCHEMBL2906031 0.88 CPT1A (0.77) CPT1ACPT2CPT1BSTAT3PPARG
SCHEMBL3564134 0.86 CPT1A (1.00) CPT1ACPT2CPT1BPPARGPPARD
SCHEMBL3577725 0.85 CPT1A (0.75) CPT1ACPT2CPT1BSTAT3PPARG
SCHEMBL3571256 0.84 CPT1A (0.80) CPT1ACPT2CPT1BSTAT3PPARG
SCHEMBL2897606 0.82 CPT1A (1.00) CPT1ACPT2CPT1BPPARGPPARD
SCHEMBL27736552 0.77 CPT1A (0.73) CPT1ACPT2CPT1BSTAT3PPARG
SCHEMBL27715638 0.76 CPT1A (0.55) CPT1ACPT2CPT1BPPARGPPARD
SCHEMBL2906020 0.75 CPT1A (0.77) CPT1ACPT2CPT1BSTAT3PPARG
SCHEMBL2904665 0.74 CPT1A (0.82) CPT1ACPT2CPT1B

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-1926711-B1 NOVEL HETEROBICYCLIC DERIVATIVES USEFUL AS INHIBITORS OF LIVER CARNITINE PALMITOYL TRANSFERASE HOFFMANN LA ROCHE (CH) 2012-11-07 EP disclosed
US-7713996-B2 Indolyl derivatives which are L-CPT1 inhibitors HOFFMANN-LA ROCHE INC. (US) 2010-05-11 US disclosed
EP-1926711-A1 NOVEL HETEROBICYCLIC DERIVATIVES USEFUL AS INHIBITORS OF LIVER CARNITINE PALMITOYL TRANSFERASE F.HOFFMANN-LA ROCHE AG (CH) 2008-06-04 EP disclosed
WO-2007031429-A1 NOVEL HETEROBICYCLIC DERIVATIVES USEFUL AS INHIBITORS OF LIVER CARNITINE PALMITOYL TRANSFERASE F. HOFFMANN-LA ROCHE AG (CH) 2007-03-22 WO disclosed
US-20070060567-A1 Novel indolyl derivatives which are L-CPT1 inhibitors F. HOFFMANN-LA ROCHE AG, A SWISS COMPANY (CH) 2007-03-15 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-20070060567-A1 Novel indolyl derivatives which are L-CPT1 inhibitors CPT1A, CPT1B, CPT2 CPT1A 1/4885CPT2 3/4885CPT1B 2/4885

“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.