SCHEMBL3573791

SCHEMBL3573791

CCOC(=O)c1ccc(NC(=O)c2cc(OC)c3c(c2)N(S(=O)(=O)c2cccc(Cl)c2)CC3)cc1

nearest known ligand 0.60

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.60
CPT1A P50416 11/20 0.57
CPT1B Q92523 10/20 0.57
CPT2 P23786 8/20 0.57
SMN1; SMN2 Q16637 3/20 0.53
KMT2A Q03164 3/20 0.53
ALDH1A1 P00352 2/20 0.53
TP53 P04637 2/20 0.53
MEN1 O00255 2/20 0.53
USP2 O75604 1/20 0.53
LMNA P02545 1/20 0.53
GAA P10253 1/20 0.53
MAPK1 P28482 1/20 0.53

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
SCHEMBL3570410 0.90 MAPT (0.54) MAPTCPT1ACPT1BCPT2SMN1; SMN2
SCHEMBL3580790 0.89 CPT1A (0.60) MAPTCPT1ACPT1BCPT2
SCHEMBL3579488 0.89 CPT1A (0.68) MAPTCPT1ACPT1BCPT2SMN1; SMN2
SCHEMBL30015611 0.89 CPT1A (0.68) MAPTCPT1ACPT1BCPT2SMN1; SMN2
SCHEMBL3573751 0.88 CPT1A (0.74) MAPTCPT1ACPT1BCPT2
SCHEMBL3576685 0.85 CPT1A (0.61) MAPTCPT1ACPT1BCPT2SMN1; SMN2
SCHEMBL3569709 0.84 CPT1A (0.66) MAPTCPT1ACPT1BCPT2SMN1; SMN2
SCHEMBL3577008 0.83 CPT1A (0.82) MAPTCPT1ACPT1BCPT2
SCHEMBL3571493 0.83 CPT1A (0.70) MAPTCPT1ACPT1BCPT2
SCHEMBL30016507 0.83 CPT1A (0.70) MAPTCPT1ACPT1BCPT2

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 MAPT 1807/4885CPT1A 1/4885CPT1B 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.